diff --git a/.github/workflows/burn_cell_metal_chem.yml b/.github/workflows/burn_cell_metal_chem.yml new file mode 100644 index 0000000000..03386c4640 --- /dev/null +++ b/.github/workflows/burn_cell_metal_chem.yml @@ -0,0 +1,126 @@ +name: burn_cell_metal_chem + +on: [pull_request] + +jobs: + burn_cell_metal_chem: + runs-on: ubuntu-latest + + steps: + - uses: actions/checkout@v4 + with: + fetch-depth: 0 + + - name: Get AMReX + run: | + mkdir external + cd external + git clone https://github.com/AMReX-Codes/amrex.git + cd amrex + git checkout development + echo 'AMREX_HOME=$(GITHUB_WORKSPACE)/external/amrex' >> $GITHUB_ENV + echo $AMREX_HOME + if [[ -n "${AMREX_HOME}" ]]; then exit 1; fi + cd ../.. + + - name: Install dependencies + run: | + sudo apt-get update -y -qq + sudo apt-get -qq -y install curl cmake jq clang g++>=9.3.0 + + - name: Compile + run: | + cd unit_test/burn_cell_metal_chem + make -j 2 + + - name: Run and compare outputs for different Z values + run: | + set -e + cd unit_test/burn_cell_metal_chem + + declare -A line_numbers_map=( + ["Z=1"]="4461 4463 4465 4467 4468 4471 4472 4475 4481 4486" + ["Z=1_z10"]="1613 1615 4456 4458 4460 4463 4470 4476 4481" + ["Z=1e-1"]="4438 4440 4442 4444 4445 4448 4449 4452 4458 4463" + ["Z=1e-2"]="4438 4440 4442 4444 4445 4448 4449 4452 4458 4463" + ["Z=1e-3"]="4438 4440 4442 4444 4445 4448 4449 4452 4458 4463" + ["Z=1e-4"]="4438 4440 4442 4444 4445 4448 4449 4452 4458 4463" + ["Z=1e-5"]="4438 4440 4442 4444 4445 4448 4449 4452 4458 4463" + ["Z=1e-6"]="4438 4440 4442 4444 4445 4448 4449 4452 4458 4463" + ) + + declare -A ref_map=( + ["Z=1"]="reference_solution_1.out" + ["Z=1_z10"]="reference_solution_1_z10.out" + ["Z=1e-1"]="reference_solution_1e-1.out" + ["Z=1e-2"]="reference_solution_1e-2.out" + ["Z=1e-3"]="reference_solution_1e-3.out" + ["Z=1e-4"]="reference_solution_1e-4.out" + ["Z=1e-5"]="reference_solution_1e-5.out" + ["Z=1e-6"]="reference_solution_1e-6.out" + ) + + ref_line_number_z10=(1 2 3 5 7 10 17 23 28) + + # Original input file + original_input_file="inputs_metal_chem_1" + modified_input_file="inputs_metal_chem_modified" + + for Z in "Z=1" "Z=1_z10" "Z=1e-1" "Z=1e-2" "Z=1e-3" "Z=1e-4" "Z=1e-5" "Z=1e-6"; do + cp $original_input_file $modified_input_file + Z_val=${Z//Z=/} + + if [[ "$Z" == "Z=1_z10" ]]; then + # Modify the redshift line for Z=1_z10 + sed -i 's/network.redshift = 0.0/network.redshift = 10.0/g' $modified_input_file + else + # Replace the metallicity and dust2gas_ratio values for other Z values + sed -i 's/network.metallicity = .*/network.metallicity = '"$Z_val"'/g' $modified_input_file + sed -i 's/network.dust2gas_ratio = .*/network.dust2gas_ratio = '"$Z_val"'/g' $modified_input_file + fi + + output_file="test_${Z_val}.out" + ./main1d.gnu.DEBUG.ex $modified_input_file amrex.fpe_trap_{invalid,zero,overflow}=1 > $output_file + + line_numbers="${line_numbers_map[$Z]}" + ref_file="${ref_map[$Z]}" + + error_found=false + index=0 + for line_number in $line_numbers; do + value1=$(awk 'NR=='"$line_number"' {match($0, /[+-]?[0-9]+([.][0-9]+)?[eE]?[+-]?[0-9]+/); if (RSTART) print substr($0, RSTART, RLENGTH); else print 0}' $output_file) + + # Adjust the line number for the reference file + if [[ "$Z" == "Z=1" ]]; then + reference_line_number=$((line_number - 4460)) + elif [[ "$Z" == "Z=1_z10" ]]; then + reference_line_number=${ref_line_number_z10[$index]} + else + reference_line_number=$((line_number - 4437)) + fi + + value2=$(awk 'NR=='"$reference_line_number"' {match($0, /[+-]?[0-9]+([.][0-9]+)?[eE]?[+-]?[0-9]+/); if (RSTART) print substr($0, RSTART, RLENGTH)}' $ref_file) + + difference=$(awk -v val1="$value1" -v val2="$value2" 'BEGIN { printf "%.2f", (val1 - val2) / val2 }') + + if (( $(echo "$difference > 0.01" | bc -l) )); then + echo "Z: $Z" + echo "Line number: $line_number" + echo "Value in $output_file: $value1" + echo "Value in $ref_file: $value2" + echo "Difference between test and reference value is $difference, more than allowed threshold of 0.01" + echo + error_found=true + fi + index=$((index + 1)) + done + + if [[ $error_found == true ]]; then + exit 1 + fi + done + + - name: Print backtrace if any failure + if: ${{ failure() && hashFiles('unit_test/burn_cell_metal_chem/Backtrace.0') != '' }} + run: cat unit_test/burn_cell_metal_chem/Backtrace.0 + diff --git a/.github/workflows/macos_build_cell_metal_chem.yml b/.github/workflows/macos_build_cell_metal_chem.yml new file mode 100644 index 0000000000..581fdd82af --- /dev/null +++ b/.github/workflows/macos_build_cell_metal_chem.yml @@ -0,0 +1,22 @@ +name: macos_burn_cell_metal_chem + +on: [pull_request] +jobs: + burn_cell: + runs-on: macos-13 + steps: + - uses: actions/checkout@v4 + with: + fetch-depth: 0 + + - name: Install dependencies + run: | + brew install cmake openmpi python3 || true + brew link --overwrite python@3.11 + + - name: Compile and run + run: | + mkdir build && cd build + cmake .. -DBUILD_UNIT_TEST_MC=true -DBUILD_AMReX=true + make -j2 + ctest --output-on-failure diff --git a/.github/workflows/macos_build_cell_primordial_chem.yml b/.github/workflows/macos_build_cell_primordial_chem.yml index fb4ac030e1..243dae2a41 100644 --- a/.github/workflows/macos_build_cell_primordial_chem.yml +++ b/.github/workflows/macos_build_cell_primordial_chem.yml @@ -17,6 +17,6 @@ jobs: - name: Compile and run run: | mkdir build && cd build - cmake .. -DBUILD_UNIT_TEST=true -DBUILD_AMReX=true + cmake .. -DBUILD_UNIT_TEST_PC=true -DBUILD_AMReX=true make -j2 ctest --output-on-failure diff --git a/CMakeLists.txt b/CMakeLists.txt index d1aceaff72..f4eb5cc45b 100644 --- a/CMakeLists.txt +++ b/CMakeLists.txt @@ -2,7 +2,7 @@ cmake_minimum_required(VERSION 3.20) project(Microphysics VERSION 1.0.0 - DESCRIPTION "building primordial_chemistry network in Microphysics with CMake" + DESCRIPTION "building primordial_chemistry or metal_chemistry networks in Microphysics with CMake" LANGUAGES CXX C) #---------------------------------------------------------------------------------------------------------------------- @@ -23,11 +23,11 @@ function(setup_target_for_microphysics_compilation network_name output_dir) set(integrationparamfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/integration/_parameters") set(unittestparamfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/unit_test/_parameters") - set(networkpropfile "${output_dir}/network_properties.H") if (${network_name} STREQUAL "gamma_law") set(EOSparamfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/EOS/gamma_law/_parameters") + set(networkpropfile "${output_dir}/network_properties.H") set(networkfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/gammalaw.net") set(networkdir "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/") set(networkheadertemplatefile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/network_header.template") @@ -44,6 +44,7 @@ function(setup_target_for_microphysics_compilation network_name output_dir) set(gamma_law_sources ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/interfaces/eos_data.cpp ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/interfaces/network_initialization.cpp ${output_dir}/extern_parameters.cpp PARENT_SCOPE) + execute_process(COMMAND python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/write_network.py" --header_template "${networkheadertemplatefile}" --header_output "${networkpropfile}" -s "${networkfile}" WORKING_DIRECTORY ${output_dir}/) elseif (${network_name} STREQUAL "primordial_chem") #need these to write extern_parameters.H @@ -52,6 +53,7 @@ function(setup_target_for_microphysics_compilation network_name output_dir) set(networkpcparamfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/primordial_chem/_parameters") #similarly, we want network_properties.H + set(networkpropfile "${output_dir}/network_properties.H") set(networkfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/primordial_chem/pynucastro.net") set(networkdir "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/primordial_chem/") set(networkheadertemplatefile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/network_header.template") @@ -71,7 +73,7 @@ function(setup_target_for_microphysics_compilation network_name output_dir) #so, if any of the _parameter files are changed, one needs to re-run 'cmake' #to generate updated header files - if(BUILD_UNIT_TEST) + if(BUILD_UNIT_TEST_PC) execute_process(COMMAND python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/util/build_scripts/write_probin.py" --pa "${paramfile} ${EOSparamfile} ${networkpcparamfile} ${networkparamfile} ${VODEparamfile} ${integrationparamfile} ${unittestparamfile}" --use_namespace WORKING_DIRECTORY ${output_dir}/) else() @@ -83,18 +85,67 @@ function(setup_target_for_microphysics_compilation network_name output_dir) set(primordial_chem_sources ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/interfaces/eos_data.cpp ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/interfaces/network_initialization.cpp ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/EOS/primordial_chem/actual_eos_data.cpp + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/primordial_chem/actual_network_data.cpp ${output_dir}/extern_parameters.cpp PARENT_SCOPE) #below for NAUX execute_process(COMMAND ${CMAKE_COMMAND} -E env "PYTHONPATH=${PYTHONPATH}:${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null" python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/get_naux.py" --net "${networkdir}" --microphysics_path "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/" WORKING_DIRECTORY ${output_dir}/) + execute_process(COMMAND python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/write_network.py" --header_template "${networkheadertemplatefile}" --header_output "${networkpropfile}" -s "${networkfile}" WORKING_DIRECTORY ${output_dir}/) + + elseif (${network_name} STREQUAL "metal_chem") + #need these to write extern_parameters.H + set(paramfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/unit_test/burn_cell_metal_chem/_parameters") + set(EOSparamfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/EOS/metal_chem/_parameters") + set(networkmcparamfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/metal_chem/_parameters") + + #similarly, we want network_properties.H + set(networkpropfile "${output_dir}/network_properties.H") + set(networkfile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/metal_chem/pynucastro.net") + set(networkdir "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/metal_chem/") + set(networkheadertemplatefile "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/network_header.template") + + #DO NOT change the order of the directories below! + set (metal_chem_dirs ${CMAKE_BINARY_DIR} ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/util ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/util/gcem/include + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/integration/VODE ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/integration/utils + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/integration ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/interfaces + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/EOS ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/EOS/metal_chem + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/metal_chem ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/constants + PARENT_SCOPE) + + #we need to have extern_parameters.cpp be available at configure time + #the script write_probin.py writes this .cpp file so we call it here + #note, execute_process only works on 'cmake' and not 'make' + #so, if any of the _parameter files are changed, one needs to re-run 'cmake' + #to generate updated header files + + if(BUILD_UNIT_TEST_MC) + execute_process(COMMAND python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/util/build_scripts/write_probin.py" --pa "${paramfile} ${EOSparamfile} + ${networkmcparamfile} ${networkparamfile} ${VODEparamfile} ${integrationparamfile} ${unittestparamfile}" --use_namespace WORKING_DIRECTORY ${output_dir}/) + else() + #do not need paramfile and unittestparamfile + execute_process(COMMAND python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/util/build_scripts/write_probin.py" --pa "${EOSparamfile} ${networkmcparamfile} + ${networkparamfile} ${VODEparamfile} ${integrationparamfile} " --use_namespace WORKING_DIRECTORY ${output_dir}/) + endif() + + #unlike primordial chem, we also include actual_network_data.cpp here because it is in there that we read in the Semenov opacity table + set(metal_chem_sources ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/interfaces/eos_data.cpp + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/interfaces/network_initialization.cpp + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/EOS/metal_chem/actual_eos_data.cpp + ${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/metal_chem/actual_network_data.cpp + ${output_dir}/extern_parameters.cpp PARENT_SCOPE) + + + #below for NAUX + execute_process(COMMAND ${CMAKE_COMMAND} -E env "PYTHONPATH=${PYTHONPATH}:${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null" python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/get_naux.py" --net "${networkdir}" --microphysics_path "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/" WORKING_DIRECTORY ${output_dir}/) + execute_process(COMMAND python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/write_network.py" --header_template "${networkheadertemplatefile}" --header_output "${networkpropfile}" -s "${networkfile}" WORKING_DIRECTORY ${output_dir}/) else() - message(FATAL_ERROR "Given network_name " ${network_name} " currently not supported. Use either 'gamma_law' or 'primordial_chem' ") + message(FATAL_ERROR "Given network_name " ${network_name} " currently not supported. Use either 'gamma_law' or 'primordial_chem' or 'metal_chem' ") endif() - execute_process(COMMAND python3 "${CMAKE_CURRENT_FUNCTION_LIST_DIR}/networks/general_null/write_network.py" --header_template "${networkheadertemplatefile}" --header_output "${networkpropfile}" -s "${networkfile}" WORKING_DIRECTORY ${output_dir}/) endfunction() @@ -126,8 +177,9 @@ endif() #set a cache variable that controls whether #we want to build the unit test or not -set(BUILD_UNIT_TEST false CACHE BOOL "Do you want to build the unit test? (true/false)") -message("Building unit test -- ${BUILD_UNIT_TEST}") +set(BUILD_UNIT_TEST_PC false CACHE BOOL "Do you want to build the primordial chem unit test? (true/false)") + +set(BUILD_UNIT_TEST_MC false CACHE BOOL "Do you want to build the metal chem unit test? (true/false)") add_compile_options(-Werror -Wall -Wextra) @@ -140,19 +192,28 @@ add_compile_options(-Werror -Wall -Wextra) #this will generate a warning but it will build successfully #do not need unit_test paramfiles when unit_test is not built -if(BUILD_UNIT_TEST) - setup_target_for_microphysics_compilation("primordial_chem" ${CMAKE_BINARY_DIR}) +if(BUILD_UNIT_TEST_PC AND BUILD_UNIT_TEST_MC) + message(FATAL_ERROR "Cannot build both primordial chem and metal chem tests at the same time!") +endif() +if(BUILD_UNIT_TEST_PC) + #Build primordial chem unit test + setup_target_for_microphysics_compilation("primordial_chem" ${CMAKE_BINARY_DIR}) include_directories(${primordial_chem_dirs}) - #adding unit_test as subdirectories + #adding unit_tests as subdirectories add_subdirectory(${CMAKE_CURRENT_SOURCE_DIR}/unit_test) - message("Building primordial chem unit test") -else() +elseif(BUILD_UNIT_TEST_MC) + #Build metal chem unit test + setup_target_for_microphysics_compilation("metal_chem" ${CMAKE_BINARY_DIR}) + include_directories(${metal_chem_dirs}) + + #adding unit_tests as subdirectories + add_subdirectory(${CMAKE_CURRENT_SOURCE_DIR}/unit_test) message("Not building primordial chem unit test") endif() - +#Sample command: cmake .. -DBUILD_UNIT_TEST_MC=True -DBUILD_AMReX=True -DAMReX_SPACEDIM=1 diff --git a/EOS/metal_chem/Make.package b/EOS/metal_chem/Make.package new file mode 100644 index 0000000000..c27842afcb --- /dev/null +++ b/EOS/metal_chem/Make.package @@ -0,0 +1,3 @@ +CEXE_headers += actual_eos.H +CEXE_headers += actual_eos_data.H +CEXE_sources += actual_eos_data.cpp diff --git a/EOS/metal_chem/_parameters b/EOS/metal_chem/_parameters new file mode 100644 index 0000000000..8fa847fd87 --- /dev/null +++ b/EOS/metal_chem/_parameters @@ -0,0 +1,141 @@ +@namespace: eos + +eos_gamma_default real 1.4 + +# define the specie names, and their masses and gammas +species_1_name string "co_ice" +species_1_gamma real 5./3. +species_1_mass real 0.0 + +species_2_name string "h2o_ice" +species_2_gamma real 5./3. +species_2_mass real 0.0 + +species_3_name string "elec" +species_3_gamma real 5./3. +species_3_mass real 9.10938188e-28 + +species_4_name string "hp" +species_4_gamma real 5./3. +species_4_mass real 1.67262158e-24 + +species_5_name string "h" +species_5_gamma real 5./3. +species_5_mass real 1.67353251819e-24 + +species_6_name string "hm" +species_6_gamma real 5./3. +species_6_mass real 1.67444345638e-24 + +species_7_name string "dp" +species_7_gamma real 5./3. +species_7_mass real 3.34512158e-24 + +species_8_name string "d" +species_8_gamma real 5./3. +species_8_mass real 3.34603251819e-24 + +species_9_name string "h2p" +species_9_gamma real 1.4 +species_9_mass real 3.34615409819e-24 + +species_10_name string "dm" +species_10_gamma real 5./3. +species_10_mass real 3.34694345638e-24 + +species_11_name string "h2" +species_11_gamma real 1.4 +species_11_mass real 3.34706503638e-24 + +species_12_name string "hdp" +species_12_gamma real 1.4 +species_12_mass real 5.01865409819e-24 + +species_13_name string "hd" +species_13_gamma real 1.4 +species_13_mass real 5.01956503638e-24 + +species_14_name string "hepp" +species_14_gamma real 5./3. +species_14_mass real 6.69024316e-24 + +species_15_name string "hep" +species_15_gamma real 5./3. +species_15_mass real 6.69115409819e-24 + +species_16_name string "he" +species_16_gamma real 5./3. +species_16_mass real 6.69206503638e-24 + +species_17_name string "cp" +species_17_gamma real 5./3. +species_17_mass real 2.007528417094e-23 + +#carbon cannot be declared as c because it conflicts with namespace C used for physical constants +species_18_name string "carbon" +species_18_gamma real 5./3. +species_18_mass real 2.0076195109128e-23 + +species_19_name string "ch" +species_19_gamma real 1.4 +species_19_mass real 2.1749727627316e-23 + +species_20_name string "ch2" +species_20_gamma real 1.4 +species_20_mass real 2.3423260145503998e-23 + +species_21_name string "ch3" +species_21_gamma real 1.4 +species_21_mass real .5096792663692e-23 + +species_22_name string "op" +species_22_gamma real 5./3. +species_22_mass real 2.6767349207316e-23 + +species_23_name string "o" +species_23_gamma real 5./3. +species_23_mass real 2.6768260145504e-23 + +species_24_name string "ch4" +species_24_gamma real 1.4 +species_24_mass real 2.677032518188e-23 + +species_25_name string "ohp" +species_25_gamma real 1.4 +species_25_mass real 2.8440881725504e-23 + +species_26_name string "oh" +species_26_gamma real 1.4 +species_26_mass real 2.8441792663692003e-23 + +species_27_name string "h2op" +species_27_gamma real 1.4 +species_27_mass real 3.0114414243692e-23 + +species_28_name string "h2o" +species_28_gamma real 1.4 +species_28_mass real 3.011532518188e-23 + +species_29_name string "h3op" +species_29_gamma real 1.4 +species_29_mass real 3.178794676188e-23 + +species_30_name string "cop" +species_30_gamma real 1.4 +species_30_mass real 4.6843544316444e-23 + +species_31_name string "co" +species_31_gamma real 1.4 +species_31_mass real 4.6844455254632e-23 + +species_32_name string "o2p" +species_32_gamma real 1.4 +species_32_mass real 5.353560935282e-23 + +species_33_name string "o2" +species_33_gamma real 1.4 +species_33_mass real 5.3536520291008e-23 + +species_34_name string "co2" +species_34_gamma real 1.4 +species_34_mass real 7.3612715400136e-23 diff --git a/EOS/metal_chem/actual_eos.H b/EOS/metal_chem/actual_eos.H new file mode 100644 index 0000000000..8c3b35d6b9 --- /dev/null +++ b/EOS/metal_chem/actual_eos.H @@ -0,0 +1,263 @@ +#ifndef ACTUAL_EOS_H +#define ACTUAL_EOS_H + +// This is a mult-gamma EOS for metal ISM chemistry. +// Each species can have its own gamma, but +// otherwise, they all act as an ideal gas. + +#include +#include +#include +#include +#include +#include + +const std::string eos_name = "multigamma"; + +inline +void actual_eos_init () +{ + + for (int n = 0; n < NumSpec; ++n) { + gammas[n] = eos_rp::eos_gamma_default; + spmasses[n] = 1.67353251819e-24; + } + + int idx; + + // Set the gammas & masses for the species + #define GET_SPECIES_PARAMS(num) do { \ + idx = network_spec_index(eos_rp::species_##num##_name); \ + if (idx >= 0) { \ + gammas[idx] = eos_rp::species_##num##_gamma; \ + spmasses[idx] = eos_rp::species_##num##_mass; \ + } \ + } while (0) + + GET_SPECIES_PARAMS(1); + GET_SPECIES_PARAMS(2); + GET_SPECIES_PARAMS(3); + GET_SPECIES_PARAMS(4); + GET_SPECIES_PARAMS(5); + GET_SPECIES_PARAMS(6); + GET_SPECIES_PARAMS(7); + GET_SPECIES_PARAMS(8); + GET_SPECIES_PARAMS(9); + GET_SPECIES_PARAMS(10); + GET_SPECIES_PARAMS(11); + GET_SPECIES_PARAMS(12); + GET_SPECIES_PARAMS(13); + GET_SPECIES_PARAMS(14); + GET_SPECIES_PARAMS(15); + GET_SPECIES_PARAMS(16); + GET_SPECIES_PARAMS(17); + GET_SPECIES_PARAMS(18); + GET_SPECIES_PARAMS(19); + GET_SPECIES_PARAMS(20); + GET_SPECIES_PARAMS(21); + GET_SPECIES_PARAMS(22); + GET_SPECIES_PARAMS(23); + GET_SPECIES_PARAMS(24); + GET_SPECIES_PARAMS(25); + GET_SPECIES_PARAMS(26); + GET_SPECIES_PARAMS(27); + GET_SPECIES_PARAMS(28); + GET_SPECIES_PARAMS(29); + GET_SPECIES_PARAMS(30); + GET_SPECIES_PARAMS(31); + GET_SPECIES_PARAMS(32); + GET_SPECIES_PARAMS(33); + GET_SPECIES_PARAMS(34); + + #undef GET_SPECIES_PARAMS + +} + + +template +AMREX_GPU_HOST_DEVICE AMREX_INLINE +bool is_input_valid (I input) +{ + static_assert(std::is_same_v, "input must be either eos_input_rt or eos_input_re"); + + bool valid = false; + + if (input == eos_input_rt || + input == eos_input_re) { + valid = true; + } + + return valid; +} + + +template +AMREX_GPU_HOST_DEVICE AMREX_INLINE +void actual_eos (I input, T& state) +{ + static_assert(std::is_same_v, "input must be either eos_input_rt or eos_input_re"); + + const amrex::Real gasconstant = C::n_A * C::k_B; + const amrex::Real protonmass = C::m_p; + // Special gamma factors + amrex::Real sum_Abarinv = 0.0_rt; + amrex::Real sum_gammasinv = 0.0_rt; + amrex::Real rhotot = 0.0_rt; + + for (int n = 0; n < NumSpec; ++n) { + rhotot += state.xn[n]*spmasses[n]; + } + + for (int n = 0; n < NumSpec; ++n) { + sum_Abarinv += state.xn[n]; + sum_gammasinv += (state.xn[n]*protonmass/rhotot) * (1.0/(gammas[n]-1.0)); + } + + sum_Abarinv *= protonmass/rhotot; + state.mu = 1.0 / sum_Abarinv; + sum_gammasinv /= sum_Abarinv; + + //------------------------------------------------------------------------- + // For all EOS input modes EXCEPT eos_input_rt, first compute dens + // and temp as needed from the inputs. + //------------------------------------------------------------------------- + + amrex::Real temp = NAN; + amrex::Real dens = NAN; + amrex::Real eint = NAN; + + switch (input) { + + case eos_input_rt: + + // dens, temp and xmass are inputs + // We don't need to do anything here + + temp = state.T; + dens = state.rho; + eint = sum_gammasinv * sum_Abarinv * gasconstant * state.T; + break; + + case eos_input_re: + + // dens, energy, and xmass are inputs + // Solve for the temperature + + if constexpr (has_energy::value) { + dens = state.rho; + + // stop the integration if the internal energy < 0 + AMREX_ASSERT(state.e > 0.); + temp = state.e /( sum_gammasinv * gasconstant * sum_Abarinv); + eint = state.e; + } + + break; + + case eos_input_rh: + // dens, enthalpy, and xmass are inputs +#ifndef AMREX_USE_GPU + amrex::Error("eos_input_rh is not supported"); +#endif + + break; + + case eos_input_tp: + // temp, pressure, and xmass are inputs +#ifndef AMREX_USE_GPU + amrex::Error("eos_input_tp is not supported"); +#endif + + break; + + case eos_input_rp: + // dens, pressure, and xmass are inputs + + if constexpr (has_pressure::value) { + dens = state.rho; + + // stop the integration if the pressure < 0 + AMREX_ASSERT(state.p > 0.); + eint = state.p * sum_gammasinv / dens; + temp = eint / (sum_gammasinv * gasconstant * sum_Abarinv); + } + break; + + case eos_input_ps: + // pressure, entropy, and xmass are inputs +#ifndef AMREX_USE_GPU + amrex::Error("eos_input_ps is not supported"); +#endif + + break; + + case eos_input_ph: + // pressure, enthalpy, and xmass are inputs +#ifndef AMREX_USE_GPU + amrex::Error("eos_input_ph is not supported"); +#endif + + break; + + case eos_input_th: + // temp, enthalpy, and xmass are inputs +#ifndef AMREX_USE_GPU + amrex::Error("eos_input_th is not supported"); +#endif + + break; + + default: + +#ifndef AMREX_USE_GPU + amrex::Error("EOS: invalid input."); +#endif + + break; + + } + + //------------------------------------------------------------------------- + // Now we have the density and temperature (and mass fractions / + // mu), regardless of the inputs. + //------------------------------------------------------------------------- + + state.T = temp; + state.rho = dens; + + if constexpr (has_energy::value) { + state.e = eint; + } + + if constexpr (has_pressure::value) { + amrex::Real pressure = state.rho * eint / sum_gammasinv; + state.p = pressure; + + state.dpdT = pressure / temp; + state.dpdr = pressure / dens; + state.cs = std::sqrt((1.0 + 1.0/sum_gammasinv) * state.p /state.rho); + if constexpr (has_G::value) { + state.G = 0.5 * (1.0 + (1.0 + 1.0/sum_gammasinv)); + } + } + + amrex::Real dedT = sum_gammasinv * sum_Abarinv * gasconstant; + amrex::Real dedr = 0.0_rt; + if constexpr (has_energy::value) { + state.dedT = dedT; + state.dedr = dedr; + if constexpr (has_pressure::value) { + state.dpde = state.dpdT / state.dedT; + } + } + +} + + + +inline +void actual_eos_finalize () +{ +} + +#endif diff --git a/EOS/metal_chem/actual_eos_data.H b/EOS/metal_chem/actual_eos_data.H new file mode 100644 index 0000000000..5a06b0cd44 --- /dev/null +++ b/EOS/metal_chem/actual_eos_data.H @@ -0,0 +1,11 @@ +#ifndef actual_eos_data_H +#define actual_eos_data_H + +#include +#include +#include + +extern AMREX_GPU_MANAGED amrex::Real gammas[NumSpec]; +extern AMREX_GPU_MANAGED amrex::Real spmasses[NumSpec]; + +#endif diff --git a/EOS/metal_chem/actual_eos_data.cpp b/EOS/metal_chem/actual_eos_data.cpp new file mode 100644 index 0000000000..e2559d5ec0 --- /dev/null +++ b/EOS/metal_chem/actual_eos_data.cpp @@ -0,0 +1,4 @@ +#include + +AMREX_GPU_MANAGED amrex::Real gammas[NumSpec]; +AMREX_GPU_MANAGED amrex::Real spmasses[NumSpec]; diff --git a/EOS/primordial_chem/_parameters b/EOS/primordial_chem/_parameters index 30ec562070..c3dda14b25 100644 --- a/EOS/primordial_chem/_parameters +++ b/EOS/primordial_chem/_parameters @@ -3,58 +3,58 @@ eos_gamma_default real 1.4 # define the specie names, and their masses and gammas -species_a_name string "elec" -species_a_gamma real 5./3. -species_a_mass real 9.10938188e-28 +species_1_name string "elec" +species_1_gamma real 5./3. +species_1_mass real 9.10938188e-28 -species_b_name string "hp" -species_b_gamma real 5./3. -species_b_mass real 1.67262158e-24 +species_2_name string "hp" +species_2_gamma real 5./3. +species_2_mass real 1.67262158e-24 -species_c_name string "h" -species_c_gamma real 5./3. -species_c_mass real 1.67353251819e-24 +species_3_name string "h" +species_3_gamma real 5./3. +species_3_mass real 1.67353251819e-24 -species_d_name string "hm" -species_d_gamma real 5./3. -species_d_mass real 1.67444345638e-24 +species_4_name string "hm" +species_4_gamma real 5./3. +species_4_mass real 1.67444345638e-24 -species_e_name string "dp" -species_e_gamma real 5./3. -species_e_mass real 3.34512158e-24 +species_5_name string "dp" +species_5_gamma real 5./3. +species_5_mass real 3.34512158e-24 -species_f_name string "d" -species_f_gamma real 5./3. -species_f_mass real 3.34603251819e-24 +species_6_name string "d" +species_6_gamma real 5./3. +species_6_mass real 3.34603251819e-24 -species_g_name string "h2p" -species_g_gamma real 1.4 -species_g_mass real 3.34615409819e-24 +species_7_name string "h2p" +species_7_gamma real 1.4 +species_7_mass real 3.34615409819e-24 -species_h_name string "dm" -species_h_gamma real 5./3. -species_h_mass real 3.34694345638e-24 +species_8_name string "dm" +species_8_gamma real 5./3. +species_8_mass real 3.34694345638e-24 -species_i_name string "h2" -species_i_gamma real 1.4 -species_i_mass real 3.34706503638e-24 +species_9_name string "h2" +species_9_gamma real 1.4 +species_9_mass real 3.34706503638e-24 -species_j_name string "hdp" -species_j_gamma real 1.4 -species_j_mass real 5.01865409819e-24 +species_10_name string "hdp" +species_10_gamma real 1.4 +species_10_mass real 5.01865409819e-24 -species_k_name string "hd" -species_k_gamma real 1.4 -species_k_mass real 5.01956503638e-24 +species_11_name string "hd" +species_11_gamma real 1.4 +species_11_mass real 5.01956503638e-24 -species_l_name string "hepp" -species_l_gamma real 5./3. -species_l_mass real 6.69024316e-24 +species_12_name string "hepp" +species_12_gamma real 5./3. +species_12_mass real 6.69024316e-24 -species_m_name string "hep" -species_m_gamma real 5./3. -species_m_mass real 6.69115409819e-24 +species_13_name string "hep" +species_13_gamma real 5./3. +species_13_mass real 6.69115409819e-24 -species_n_name string "he" -species_n_gamma real 5./3. -species_n_mass real 6.69206503638e-24 +species_14_name string "he" +species_14_gamma real 5./3. +species_14_mass real 6.69206503638e-24 diff --git a/EOS/primordial_chem/actual_eos.H b/EOS/primordial_chem/actual_eos.H index 9d743432ab..a1427f1a08 100644 --- a/EOS/primordial_chem/actual_eos.H +++ b/EOS/primordial_chem/actual_eos.H @@ -27,90 +27,31 @@ void actual_eos_init () int idx; - idx = network_spec_index(eos_rp::species_a_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_a_gamma; - spmasses[idx] = eos_rp::species_a_mass; - } - - idx = network_spec_index(eos_rp::species_b_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_b_gamma; - spmasses[idx] = eos_rp::species_b_mass; - } - - idx = network_spec_index(eos_rp::species_c_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_c_gamma; - spmasses[idx] = eos_rp::species_c_mass; - } - - idx = network_spec_index(eos_rp::species_d_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_d_gamma; - spmasses[idx] = eos_rp::species_d_mass; - } - - idx = network_spec_index(eos_rp::species_e_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_e_gamma; - spmasses[idx] = eos_rp::species_e_mass; - } - - idx = network_spec_index(eos_rp::species_f_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_f_gamma; - spmasses[idx] = eos_rp::species_f_mass; - } - - idx = network_spec_index(eos_rp::species_g_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_g_gamma; - spmasses[idx] = eos_rp::species_g_mass; - } - - idx = network_spec_index(eos_rp::species_h_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_h_gamma; - spmasses[idx] = eos_rp::species_h_mass; - } - - idx = network_spec_index(eos_rp::species_i_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_i_gamma; - spmasses[idx] = eos_rp::species_i_mass; - } - - idx = network_spec_index(eos_rp::species_j_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_j_gamma; - spmasses[idx] = eos_rp::species_j_mass; - } - - idx = network_spec_index(eos_rp::species_k_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_k_gamma; - spmasses[idx] = eos_rp::species_k_mass; - } - - idx = network_spec_index(eos_rp::species_l_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_l_gamma; - spmasses[idx] = eos_rp::species_l_mass; - } - - idx = network_spec_index(eos_rp::species_m_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_m_gamma; - spmasses[idx] = eos_rp::species_m_mass; - } - - idx = network_spec_index(eos_rp::species_n_name); - if (idx >= 0) { - gammas[idx] = eos_rp::species_n_gamma; - spmasses[idx] = eos_rp::species_n_mass; - } - + // Set the gammas & masses for the species + #define GET_SPECIES_PARAMS(num) do { \ + idx = network_spec_index(eos_rp::species_##num##_name); \ + if (idx >= 0) { \ + gammas[idx] = eos_rp::species_##num##_gamma; \ + spmasses[idx] = eos_rp::species_##num##_mass; \ + } \ + } while (0) + + GET_SPECIES_PARAMS(1); + GET_SPECIES_PARAMS(2); + GET_SPECIES_PARAMS(3); + GET_SPECIES_PARAMS(4); + GET_SPECIES_PARAMS(5); + GET_SPECIES_PARAMS(6); + GET_SPECIES_PARAMS(7); + GET_SPECIES_PARAMS(8); + GET_SPECIES_PARAMS(9); + GET_SPECIES_PARAMS(10); + GET_SPECIES_PARAMS(11); + GET_SPECIES_PARAMS(12); + GET_SPECIES_PARAMS(13); + GET_SPECIES_PARAMS(14); + + #undef GET_SPECIES_PARAMS } diff --git a/README.md b/README.md index 3986a9e72b..74c9cf283d 100644 --- a/README.md +++ b/README.md @@ -46,36 +46,12 @@ There are several core types of microphysics routines hosted here: * `screening/`: the screening routines for nuclear reactions. These are called by the various networks -* `unit_test/`: code specific to unit tests within this repo. In - particular, +* `unit_test/`: a collection of unit tests that exercise the different + pieces of Microphysics - - `burn_cell` will do a single zone burn given (rho, T) - and a composition - - - `burn_cell_sdc` will do a single zone burn in the simplified-SDC - framework. - - - `test_eos` will test an equation of state by first calling it with - (rho, T), and then calling it with other inputs to recover rho - and/or T. A cube of data, with rho, T, and X is tested. - - - `test_react` will call a reaction network on a cube of - data (rho, T, X). - - - `test_rhs` will evaluate the right-hand-side of a network - without integrating it. - - - `test_sdc` tests integration using the set of variables for - simplified-SDC. - - - `test_jac` evaluates the Jacobian for comparison between the - analytical and numerical Jacobians. - - - `test_screening` evaluates the screening routines. - -* `util`: linear algebra routines for the integrators - (specifically a linear system solver from LINPACK), - other math routines, and build scripts +* `util`: linear algebra routines for the integrators (specifically a + linear system solver from LINPACK), the hybrid Powell solver, other + math routines, and build scripts # AMReX-Astro Codes @@ -88,7 +64,7 @@ the AMReX-Astro codes, Maestro and Castro. * MAESTROeX: http://amrex-astro.github.io/MAESTROeX/ * Quokka: https://quokka-astro.github.io/quokka/ - + To use this repository with AMReX codes, set `MICROPHYSICS_HOME` to point to the `Microphysics/` directory. diff --git a/integration/integrator_setup_strang.H b/integration/integrator_setup_strang.H index 32ec74342c..4afc1552bc 100644 --- a/integration/integrator_setup_strang.H +++ b/integration/integrator_setup_strang.H @@ -210,14 +210,14 @@ void integrator_cleanup (IntegratorT& int_state, BurnT& state, std::cout << "temp start = " << std::setprecision(16) << state_save.T_in << std::endl; std::cout << "xn start = "; for (const double X : state_save.xn_in) { - std::cout << std::setprecision(16) << X << " "; + std::cout << std::scientific << std::setprecision(16) << X << " "; } std::cout << std::endl; std::cout << "dens current = " << std::setprecision(16) << state.rho << std::endl; std::cout << "temp current = " << std::setprecision(16) << state.T << std::endl; std::cout << "xn current = "; for (const double X : state.xn) { - std::cout << std::setprecision(16) << X << " "; + std::cout << std::scientific << std::setprecision(16) << X << " "; } std::cout << std::endl; std::cout << "energy generated = " << state.e << std::endl; diff --git a/networks/metal_chem/Make.package b/networks/metal_chem/Make.package new file mode 100644 index 0000000000..e048cb9388 --- /dev/null +++ b/networks/metal_chem/Make.package @@ -0,0 +1,7 @@ +CEXE_headers += network_properties.H + +ifeq ($(USE_REACT),TRUE) + CEXE_sources += actual_network_data.cpp + CEXE_headers += actual_network.H + CEXE_headers += actual_rhs.H +endif diff --git a/networks/metal_chem/README b/networks/metal_chem/README new file mode 100644 index 0000000000..a64fd23ae7 --- /dev/null +++ b/networks/metal_chem/README @@ -0,0 +1,2 @@ +#ISM chemical network including primordial chemistry with metals +#Author: Piyush Sharda (2024) diff --git a/networks/metal_chem/_parameters b/networks/metal_chem/_parameters new file mode 100644 index 0000000000..48dd3b7fe5 --- /dev/null +++ b/networks/metal_chem/_parameters @@ -0,0 +1,30 @@ +@namespace: network + + +# cutoff for species mass fractions +small_x real 1.e-100 +# redshift for metal chem (Pop II/I star formation) +redshift real 0e0 +# metallicity for metal chem (Pop II/I star formation) +metallicity real 1e0 +# dust to gas ratio relative to solar +dust2gas_ratio real 1e0 +# starting index for gas-phase species (after the ices) +idx_gas_species int 2 + +# Cosmic ray ionization rate (per s) +crate real 0e0 +# Av +Av real 0e0 +# H ionization rate (per s) +ionH real 0e0 +# H2 ionization rate (per s) +ionH2 real 0e0 +# H2 dissociation rate (per s) +dissH2 real 0e0 +# C ionization rate (per s) +ionC real 0e0 +# O ionization rate (per s) +ionO real 0e0 +# CO dissociation rate (per s) +dissCO real 0e0 diff --git a/networks/metal_chem/actual_network.H b/networks/metal_chem/actual_network.H new file mode 100644 index 0000000000..a9329bb768 --- /dev/null +++ b/networks/metal_chem/actual_network.H @@ -0,0 +1,39 @@ +#ifndef actual_network_H +#define actual_network_H + +#include +#include +#include +#include + +#include +#include +#include + +using namespace amrex; + +void actual_network_init(); + +const std::string network_name = "pynucastro-cxx"; + +namespace network +{ + extern AMREX_GPU_MANAGED Array1D semenov_x; + extern AMREX_GPU_MANAGED Array1D semenov_y; + extern AMREX_GPU_MANAGED Array2D semenov_z; + +} + +namespace Rates +{ + + enum NetworkRates + { + }; + +} + + +void balance_charge(burn_t& state); + +#endif diff --git a/networks/metal_chem/actual_network_data.cpp b/networks/metal_chem/actual_network_data.cpp new file mode 100644 index 0000000000..e86f1548aa --- /dev/null +++ b/networks/metal_chem/actual_network_data.cpp @@ -0,0 +1,73 @@ +#include + +namespace network +{ + + AMREX_GPU_MANAGED Array1D semenov_x; + AMREX_GPU_MANAGED Array1D semenov_y; + AMREX_GPU_MANAGED Array2D semenov_z; + +} + +void actual_network_init() +{ + + using namespace network; + std::string filename = "Semenov_PlanckOpacity.dat"; + std::cout << "Reading tables from " << filename << std::endl; + + // Open the file and check if it exists + std::ifstream file(filename); + if (!file.is_open()) { + throw std::runtime_error("ERROR: file " + filename + " not found!"); + } + + std::string line; + + // Skip comments and read until the first non-comment line + while (std::getline(file, line)) { + if (line[0] != '#') { + break; + } + } + + // Check if the first line is formatted correctly + if (line.find(',') == std::string::npos) { + throw std::runtime_error("ERROR: file " + filename + " should contain the number of rows and columns in the format 'RR, CC'"); + } + + // Process data line by line + for (size_t i = 1; i <= semenov_x.size(); ++i) { + for (size_t j = 1; j <= semenov_y.size(); ++j) { + if (!std::getline(file, line)) { + throw std::runtime_error("ERROR: Unexpected end of file while reading data."); + } + + // Trim the line to remove any leading/trailing whitespace + line.erase(0, line.find_first_not_of(" \t")); // Remove leading whitespace + line.erase(line.find_last_not_of(" \t") + 1); // Remove trailing whitespace + + std::istringstream iss(line); + Real x_val, y_val, z_val; + if (!(iss >> x_val >> y_val >> z_val)) { + std::cout << "line: " << line << std::endl; + throw std::runtime_error("ERROR: Insufficient data on line " + std::to_string(i * semenov_y.size() + j + 1)); + } + + semenov_x(i) = x_val; + semenov_y(j) = y_val; + semenov_z(i,j) = z_val; + } + + } +} + +void balance_charge(burn_t& state) +{ + + // update the number density of electrons due to charge conservation + state.xn[2] = -state.xn[5] - state.xn[9] + state.xn[3] + state.xn[6] + state.xn[8] + + 2.0 * state.xn[13] + state.xn[11] + state.xn[14] + state.xn[16] + state.xn[21] + + state.xn[24] + state.xn[26] + state.xn[28] + state.xn[29] + state.xn[31]; + +} \ No newline at end of file diff --git a/networks/metal_chem/actual_rhs.H b/networks/metal_chem/actual_rhs.H new file mode 100644 index 0000000000..3e96e81cd3 --- /dev/null +++ b/networks/metal_chem/actual_rhs.H @@ -0,0 +1,4245 @@ +#ifndef actual_rhs_H +#define actual_rhs_H + +#include +#include + +#include +#include +#include +#include + +using namespace amrex; +using namespace ArrayUtil; +using namespace network_rp; +using namespace network; + + + +AMREX_GPU_HOST_DEVICE AMREX_INLINE +void rhs_specie(const burn_t& state, + Array1D& ydot, + const Array1D& X, + Real const /*user_crate*/, Real const /*user_Av*/, + Real const /*user_ionH*/, Real const /*user_ionH2*/, + Real const /*user_dissH2*/, Real const /*user_ionC*/, + Real const /*user_ionO*/, Real const /*user_dissCO*/, + Real const user_dust2gas_ratio, Real const Tdust, + Real const z) { + + + using namespace Rates; + + Real T = state.T; + + Real x0 = 2.0e-99*X(0); + + Real x1 = std::max(T, 2.73*z + 2.73); + + Real x2 = ((x1)*(x1)); + + Real x3 = 0.002*x1 + 1.0; + + Real x4 = std::sqrt(x1); + + Real x5 = user_dust2gas_ratio*x4; + + Real x6 = x5*(3.3470650363800003e-24*X(10) + 5.0186540981899997e-24*X(11) + 5.01956503638e-24*X(12) + 6.6902431600000005e-24*X(13) + 6.6911540981899994e-24*X(14) + 6.6920650363799998e-24*X(15) + 2.007528417094e-23*X(16) + 2.0076195109127999e-23*X(17) + 2.1749727627315999e-23*X(18) + 2.3423260145503998e-23*X(19) + 9.1093818800000008e-28*X(2) + 2.5096792663692001e-23*X(20) + 2.6767349207315999e-23*X(21) + 2.6768260145504001e-23*X(22) + 2.6770325181879997e-23*X(23) + 2.8440881725504001e-23*X(24) + 2.8441792663692003e-23*X(25) + 3.0114414243691998e-23*X(26) + 3.011532518188e-23*X(27) + 3.178794676188e-23*X(28) + 4.6843544316443998e-23*X(29) + 1.6726215800000001e-24*X(3) + 4.6844455254632e-23*X(30) + 5.3535609352819999e-23*X(31) + 5.3536520291008001e-23*X(32) + 7.3612715400136001e-23*X(33) + 1.6735325181900001e-24*X(4) + 1.6744434563800001e-24*X(5) + 3.3451215800000003e-24*X(6) + 3.3460325181899999e-24*X(7) + 3.3461540981899999e-24*X(8) + 3.3469434563800003e-24*X(9))/(8.0000000000000013e-6*x2 + x3 + 0.040000000000000008*std::sqrt(x1 + 1)); + + Real x7 = 1195783.1580871048*x6 + 2.0e-99; + + Real x8 = 2.0e-99*X(1); + + Real x9 = 1491378.0618531078*x6 + 2.0e-99; + + Real x10 = 1.0/x4; + + Real x11 = 5.7884371785482823e-10*x10*std::pow(0.00060040841663220993*x4 + 1.0, -1.7524)*std::pow(0.32668576019240059*x4 + 1.0, -0.24759999999999999) + 1.0e-99; + + Real x12 = X(13)*X(2); + + Real x13 = -x11*x12; + + Real x14 = std::pow(x1, -0.69999999999999996); + + Real x15 = X(2)*X(31); + + Real x16 = x15*(-1.0568649366703787e-5*x14 - 1.0e-99); + + Real x17 = 7.1999999999999996e-8*x10 + 1.0e-99; + + Real x18 = X(11)*X(2); + + Real x19 = -x17*x18; + + Real x20 = 9.7355109978586414e-8*std::pow(x1, -0.47999999999999998) + 1.0e-99; + + Real x21 = X(2)*X(24); + + Real x22 = -x20*x21; + + Real x23 = std::log(x1); + + Real x24 = 0.10684732509875319*x23 - 1; + + Real x25 = ((x24)*(x24)); + + Real x26 = ((x24)*(x24)*(x24)); + + Real x27 = ((((x24)*(x24)))*(((x24)*(x24)))); + + Real x28 = ((x24)*(x24)*(x24)*(x24)*(x24)); + + Real x29 = std::exp((6)*std::log(std::abs(x24))); + + Real x30 = ((x24)*(x24)*(x24)*(x24)*(x24)*(x24)*(x24)); + + Real x31 = std::exp((8)*std::log(std::abs(x24))); + + Real x32 = std::pow(x1, 23.915965629999999)*std::exp(-941.91483008144996*x25 + 2506.9866529060901*x26 - 4361.9927099007555*x27 + 4879.7345146260486*x28 - 3366.4639698826941*x29 + 1300.3028484326148*x30 - 214.82451513312137*x31); + + Real x33 = 4.3524079114767552e-117*x32 + 1.0e-99; + + Real x34 = X(15)*X(2); + + Real x35 = -x33*x34; + + Real x36 = std::pow(x1, -0.75); + + Real x37 = 2.5950363272655348e-10*x36 + 1.0e-99; + + Real x38 = 2*X(2)*X(6); + + Real x39 = -x37*x38; + + Real x40 = 6.3350403285625223e-6*std::pow(x1, -0.55000000000000004) + 1.0e-99; + + Real x41 = X(2)*X(29); + + Real x42 = -x40*x41; + + Real x43 = std::pow(x1, 2.360852208681)*std::exp(-24.766609674457612*x25 + 13.307984239358756*x26 - 258.18559308467116*x27 + 846.15238706523724*x28 - 1113.0879095147111*x29 + 671.95094388835207*x30 - 154.90262957142161*x31); + + Real x44 = 3.7903999274394518e-18*x43 + 1.0e-99; + + Real x45 = X(2)*X(5); + + Real x46 = -x44*x45; + + Real x47 = 1.3300135414628029e-18*std::pow(x1, 0.94999999999999996)*std::exp(-0.00010729613733905579*x1) + 1.0e-99; + + Real x48 = X(2)*X(7); + + Real x49 = -x47*x48; + + Real x50 = std::pow(x1, 0.25); + + Real x51 = 1.0/x50; + + Real x52 = 1.0/x1; + + Real x53 = 130666.72639118577*x52; + + Real x54 = x51*std::exp(-x53)/(x53 + 0.193); + + Real x55 = 1.3023623244766063e-6*x54 + 1.0e-99; + + Real x56 = X(17)*X(2); + + Real x57 = -x55*x56; + + Real x58 = std::pow(x1, -0.34000000000000002); + + Real x59 = 157821.26811013557*x52; + + Real x60 = x58*std::exp(-x59)/(x59 + 0.072999999999999995); + + Real x61 = 2.1012161411986507e-6*x60 + 1.0e-99; + + Real x62 = X(2)*X(22); + + Real x63 = -x61*x62; + + Real x64 = std::pow(x1, 0.34999999999999998)*std::exp(-102000.0*x52); + + Real x65 = 4.3799999999999999e-10*x64 + 1.0e-99; + + Real x66 = X(10)*X(2); + + Real x67 = std::pow(x1, 43.933476326349997)*std::exp(-1618.789587733125*x25 + 3854.4033653120221*x26 - 5902.1601240760483*x27 + 5825.9326359379538*x28 - 3578.1439181805955*x29 + 1242.7294446825149*x30 - 186.35635455381879*x31); + + Real x68 = X(14)*X(2); + + Real x69 = std::pow(x1, 13.536555999999999)*std::exp(-502.72883252679094*x25 + 1281.477767828706*x26 - 2207.4643501257692*x27 + 2500.8077583366976*x28 - 1768.8867461266502*x29 + 704.19926629500367*x30 - 120.0438480494693*x31); + + Real x70 = X(2)*X(4); + + Real x71 = ((x1 <= 1160.0) ? ( + 1.4643482606109061e-16*std::pow(x1, 1.78186) +) +: ( + 0 +)); + + Real x72 = x71 + 1.0e-99; + + Real x73 = X(4)*X(5); + + Real x74 = ((x24)*(x24)*(x24)*(x24)*(x24)*(x24)*(x24)*(x24)*(x24)); + + Real x75 = ((x1 > 1160.0) ? ( + 3.3178155742407601e-14*std::pow(x1, 1.139449335841631)*std::exp(-12.447178055372776*x25 + 6.9391784778399117*x26 - 10.993097527150175*x27 + 14.449862906216714*x28 + 58.228375789703179*x29 - 162.59852239006702*x30 + 144.55426734953477*x31 - 44.454280878123605*x74) +) +: ( + 0 +)); + + Real x76 = x75 + 1.0e-99; + + Real x77 = std::sqrt(x1); + + Real x78 = 1.0/x77; + + Real x79 = 4.4686910835277033e-6*x78 + 1.0e-99; + + Real x80 = X(2)*X(28); + + Real x81 = 1.8706148721743872e-6*x78 + 1.0e-99; + + Real x82 = -x79*x80 - x80*x81; + + Real x83 = 1.4895636945092344e-6*x78 + 1.0e-99; + + Real x84 = X(2)*X(26); + + Real x85 = 6.7549981495186206e-7*x78 + 1.0e-99; + + Real x86 = -x83*x84 - x84*x85; + + Real x87 = x1 <= 10000.0; + + Real x88 = ((x87) ? ( + -5.5279999999999998e-28*((x1)*(x1)*(x1)*(x1)*(x1)) + 3.3467999999999999e-23*((((x1)*(x1)))*(((x1)*(x1)))) - 7.5474000000000004e-19*((x1)*(x1)*(x1)) - 2.3088e-11*x1 + 7.3427999999999993e-15*x2 + 4.2277999999999996e-8 +) +: ( + 0 +)); + + Real x89 = X(2)*X(8); + + Real x90 = 1.0e-8*std::pow(x1, -0.40000000000000002) + 1.0e-99; + + Real x91 = X(3)*X(5); + + Real x92 = x89*(-x88 - 1.0e-99) + x90*x91; + + Real x93 = ((x1 <= 400.0) ? ( + 1.2999999999999999e-10*std::pow(x1, -0.64000000000000001) +) +: ( + 0 +)) + 1.0e-99; + + Real x94 = X(2)*X(21); + + Real x95 = std::pow(x1, -1.5); + + Real x96 = ((x1 > 400.0) ? ( + 1.41e-10*std::pow(x1, -0.66000000000000003) + 0.00073999999999999999*x95*(1.0 + 0.062*std::exp(-145000.0*x52))*std::exp(-175000.0*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x97 = -x93*x94 - x94*x96; + + Real x98 = 1.4981088130721367e-10*std::pow(x1, -0.63529999999999998); + + Real x99 = x1 > 2.73; + + Real x100 = ((x99 && x1 <= 9280.0) ? ( + x98 +) +: ( + 0 +)) + 1.0e-99; + + Real x101 = x1 <= 100000000.0; + + Real x102 = ((x101 && x1 > 9280.0) ? ( + 1250086.112245841*x95*(1.5400000000000001e-9 + 4.6200000000000001e-10*std::exp(-93988.701501924661*x52))*std::exp(-469943.50750964211*x52) + x98 +) +: ( + 0 +)) + 1.0e-99; + + Real x103 = 3.8571873359681448e-209*x67 + 1.0e-99; + + Real x104 = -x100*x68 - x102*x68 - x103*x68; + + Real x105 = 2.6534040307116387e-9*std::pow(x1, -0.10000000000000001) + 1.0e-99; + + Real x106 = X(4)*X(9); + + Real x107 = X(5)*X(7); + + Real x108 = x105*x106 + x105*x107; + + Real x109 = ((x1 <= 7950.0) ? ( + 1.4308352583277889e-10*std::pow(x1, -0.59999999999999998) +) +: ( + 0 +)) + 1.0e-99; + + Real x110 = X(16)*X(2); + + Real x111 = ((x1 > 21140.0) ? ( + 0.00023813936486848612*std::pow(x1, -1.3700000000000001)*std::exp(-115786.2*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x112 = ((x1 <= 21140.0 && x1 > 7950.0) ? ( + 8.3535906003219973e-24*std::pow(x1, 2.4900000000000002)*std::exp(21845.599999999999*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x113 = -x109*x110 - x110*x111 - x110*x112; + + Real x114 = ((x99 && x1 <= 5500.0) ? ( + x98 +) +: ( + 0 +)) + 1.0e-99; + + Real x115 = X(2)*X(3); + + Real x116 = ((x101 && x1 > 5500.0) ? ( + 3.2867337024382733e-10*std::pow(x1, -0.7241125657826851)*std::exp(-1.7746868094247411*x25 - 1.9518356165136789*x26 - 2.4649195146505537*x27 - 1.0207737270119371*x28 + 3.3530579587656565*x29 + 3.6203127646377788*x30 - 1.0930705283186734*x31 - 1.6921001126637108*x74) +) +: ( + 0 +)) + 1.0e-99; + + Real x117 = -x114*x115 - x115*x116; + + Real x118 = 35.5*std::pow(x1, -2.2799999999999998)*std::exp(-46707.0*x52) + 1.0e-99; + + Real x119 = (1.3500000000000001e-9*std::pow(x1, 0.098492999999999997) + 4.4350199999999998e-10*std::pow(x1, 0.55610000000000004) + 3.7408500000000004e-16*std::pow(x1, 2.1825999999999999))/(0.0061910000000000003*std::pow(x1, 1.0461) + 8.9711999999999997e-11*std::pow(x1, 3.0424000000000002) + 3.2575999999999999e-14*std::pow(x1, 3.7740999999999998) + 1.0) + 1.0e-99; + + Real x120 = -x118*x66 + x119*x73 - x65*x66; + + Real x121 = 5.9082438637265071e-70*x69 + 1.0e-99; + + Real x122 = 1.4000000000000001e-18*std::pow(x1, 0.92800000000000005)*std::exp(-6.1728395061728397e-5*x1) + 1.0e-99; + + Real x123 = -x121*x70 - x122*x70; + + Real x124 = 7.9674337148168363e-7*x78 + 1.0e-99; + + Real x125 = X(3)*X(9); + + Real x126 = -x124*x125; + + Real x127 = 2.0000000000000001e-9*X(3)*X(32); + + Real x128 = -x127; + + Real x129 = 7.5e-10*X(29)*X(4); + + Real x130 = 2.8833736969617052e-16*x50 + 1.0e-99; + + Real x131 = X(14)*X(4); + + Real x132 = ((x1 > 10000.0) ? ( + 4.0000000000000003e-37*std::pow(x1, 4.7400000000000002) +) +: ( + 0 +)) + 1.0e-99; + + Real x133 = X(15)*X(3); + + Real x134 = ((x87) ? ( + 1.26e-9*x36*std::exp(-127500.0*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x135 = x130*x131 - x132*x133 - x133*x134; + + Real x136 = 6.3999999999999996e-10*X(11)*X(4); + + Real x137 = M_LN10; + + Real x138 = 1.0/x137; + + Real x139 = x138*x23; + + Real x140 = ((x23)*(x23)); + + Real x141 = std::exp((-2)*std::log(std::abs(x137))); + + Real x142 = x140*x141; + + Real x143 = 8.4600000000000008e-10*x139 - 1.3700000000000002e-10*x142 + 4.1700000000000001e-10; + + Real x144 = X(10)*X(6); + + Real x145 = 1.0e-99 + 1.0000000000000001e-9*std::exp(-457.0*x52); + + Real x146 = X(12)*X(3); + + Real x147 = x136 + x143*x144 - x145*x146; + + Real x148 = x1 <= 10.0; + + Real x149 = ((x148) ? ( + 4.2020000000000002e-8 +) +: ( + 0 +)) + 1.0e-99; + + Real x150 = X(27)*X(3); + + Real x151 = x1 > 10.0; + + Real x152 = ((x151) ? ( + 1.2730571616977901e-7*x78 + 1.767e-9 +) +: ( + 0 +)) + 1.0e-99; + + Real x153 = -x149*x150 - x150*x152; + + Real x154 = ((x151 && x1 <= 100000.0) ? ( + -7.7700000000000002e-13*x1 + 2.96e-6*x10 + 2.5000000000000002e-10*x4 - 1.73e-9 +) +: ( + 0 +)); + + Real x155 = -x90*x91 + x91*(-x154 - 1.0e-99); + + Real x156 = std::pow(10.0, -0.12690000000000001*amrex::Math::powi<-3>(x137)*((x23)*(x23)*(x23)) + 1.1180000000000001*amrex::Math::powi<-2>(x137)*((x23)*(x23)) - 1.5229999999999999*x139 - 19.379999999999999) + 1.0e-99; + + Real x157 = -x156; + + Real x158 = X(3)*X(7); + + Real x159 = x1 > 50.0; + + Real x160 = ((x159) ? ( + 2.0000000000000001e-10*std::pow(x1, 0.40200000000000002)*std::exp(-37.100000000000001*x52) - 3.3099999999999998e-17*std::pow(x1, 1.48) +) +: ( + 0 +)) + 1.0e-99; + + Real x161 = ((x159) ? ( + 2.0299999999999998e-9*std::pow(x1, -0.33200000000000002) + 2.0600000000000001e-10*std::pow(x1, 0.39600000000000002)*std::exp(-33.0*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x162 = X(4)*X(6); + + Real x163 = x157*x158 - x158*x160 + x161*x162; + + Real x164 = 8.7882738061352424e-22*std::pow(x1, 1.96)*std::exp(-170000.0*x52) + 1.0e-99; + + Real x165 = X(16)*X(4); + + Real x166 = 3.8999999999999998e-16*std::pow(x1, 0.21299999999999999) + 1.0e-99; + + Real x167 = X(17)*X(3); + + Real x168 = x164*x165 - x166*x167; + + Real x169 = ((x148) ? ( + 3.7450000000000001e-8 +) +: ( + 0 +)) + 1.0e-99; + + Real x170 = X(25)*X(3); + + Real x171 = ((x151) ? ( + 1.1352943524561152e-7*x78 + 1.55e-9 +) +: ( + 0 +)) + 1.0e-99; + + Real x172 = -x169*x170 - x170*x171; + + Real x173 = 7.5399999999999998e-10*std::pow(x1, -0.45800000000000002) + 4.9899999999999997e-11*std::pow(x1, 0.40500000000000003) + 1.0e-99; + + Real x174 = X(21)*X(4); + + Real x175 = (4.0000000000000001e-10*std::pow(x1, 0.0066899999999999998) + 1.0799999999999999e-11*std::pow(x1, 0.51700000000000002))*std::exp(-227.0*x52) + 1.0e-99; + + Real x176 = X(22)*X(3); + + Real x177 = x173*x174 - x175*x176; + + Real x178 = 6.0e-10*X(4)*X(8); + + Real x179 = ((x23)*(x23)*(x23)); + + Real x180 = ((((x23)*(x23)))*(((x23)*(x23)))); + + Real x181 = ((x23)*(x23)*(x23)*(x23)*(x23)); + + Real x182 = ((x1 <= 30000.0 && x1 > 100.0) ? ( + (-1.4491368e-7*x140 + 3.4172804999999998e-8*x179 - 4.7813727999999997e-9*x180 + 3.9731542e-10*x181 + 3.5311931999999998e-13*((x23)*(x23)*(x23)*(x23)*(x23)*(x23)*(x23)) - 1.8171411000000001e-11*std::exp((6)*std::log(std::abs(x23))) + 3.3735381999999997e-7*x23 - 3.3232183000000002e-7)*std::exp(-21237.150000000001*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x183 = X(10)*X(3); + + Real x184 = x178 - x182*x183; + + Real x185 = x179/((x137)*(x137)*(x137)); + + Real x186 = ((x1 > 30.0) ? ( + std::pow(10, -3.194*x139 + 1.786*x140*x141 - 0.2072*x185 - 18.199999999999999) +) +: ( + 0 +)) + 1.0e-99; + + Real x187 = X(3)*X(4); + + Real x188 = std::pow(x1, -0.14999999999999999); + + Real x189 = ((x1 <= 30.0) ? ( + 3.4977396723747635e-20*x188 +) +: ( + 0 +)) + 1.0e-99; + + Real x190 = -x186*x187 - x187*x189; + + Real x191 = 6.3999999999999996e-10*X(10)*X(26); + + Real x192 = -x136; + + Real x193 = 1.0000000000000001e-17*X(17); + + Real x194 = X(4)*x193; + + Real x195 = -x194; + + Real x196 = ((X(10))*(X(10))); + + Real x197 = std::log(T); + + Real x198 = 2.0*X(10) + X(11) + X(12) + X(18) + 2.0*X(19) + 3.0*X(20) + 4.0*X(23) + X(24) + X(25) + 2.0*X(26) + 2.0*X(27) + 3.0*X(28) + X(3) + X(4) + X(5) + 2.0*X(8); + + Real x199 = 1.0/(std::pow(10.0, 1.3*x138*(x197 - 9.2103403719761836) - 137.42519902360013*x141*((0.10857362047581294*x197 - 1)*(0.10857362047581294*x197 - 1)) - 4.8449999999999998)*x198 + 1.0); + + Real x200 = std::pow(1.1800000000000001e-10*std::exp(-69500.0*x52), x199)*std::pow(8.1250000000000003e-8*std::pow(T, -0.5)*(1.0 - std::exp(-6000.0*x52))*std::exp(-52000.0*x52), 1.0 - x199); + + Real x201 = 2*x200 + 2.0e-99; + + Real x202 = ((X(4))*(X(4))*(X(4))); + + Real x203 = 0.25820969999999999*x185; + + Real x204 = std::log(27535.310000000001*x52 + 1.0); + + Real x205 = -2.4640089999999999*x138*x23 + 0.19859550000000001*x142 + 743.05999999999995*x52; + + Real x206 = std::exp(-0.0022727272727272726*x1); + + Real x207 = std::exp(-0.00054054054054054055*x1); + + Real x208 = 2.9375070000000001*x206 + 0.23588480000000001*x207 + 0.75022860000000002; + + Real x209 = std::pow(10.0, 21.360939999999999*x138*x204 + 42.707410000000003*x138*x23 - 2.0273650000000001*x142 - x203 - 21467.790000000001*x52 - 1657.4099999999999*x52/(std::pow(std::pow(10.0, -x205 - 8.1313220000000008)*x198, x208) + 1.0) - 142.7664 - (21.360939999999999*x138*x204 + 11.28215*x138*std::log(14254.549999999999*x52 + 1.0) + 70.138370000000009*x139 - 4.7035149999999994*x142 - x203 - 203.11568)/(std::pow(std::pow(10.0, -x205 - 9.3055640000000004)*x198, x208) + 1.0)); + + Real x210 = 4.6331670000000003*x185; + + Real x211 = std::log(40870.379999999997*x52 + 1.0); + + Real x212 = -4.8909149999999997*x138*x23 + 0.47490300000000002*x142 - 133.82830000000001*x52; + + Real x213 = -2.0563129999999998*x206 + 0.58640729999999996*x207 + 0.82274429999999998; + + Real x214 = std::pow(10.0, 69.700860000000006*x138*x211 - 68.422430000000006*x139 + 43.20243*x140*x141 - x210 - 23705.700000000001*x52 - 2080.4099999999999*x52/(std::pow(std::pow(10.0, -x212 - 13.656822)*x198, x213) + 1.0) - 178.4239 - (69.700860000000006*x138*x211 + 19.734269999999999*x138*std::log(16780.950000000001*x52 + 1.0) - 14.509090000000008*x139 + 37.886913*x142 - x210 - 307.31920000000002)/(std::pow(std::pow(10.0, -x212 - 14.82123)*x198, x213) + 1.0)); + + Real x215 = X(10)*X(4); + + Real x216 = 1.5e-32*x51 + 5.0000000000000004e-32*x78 + 2.0e-99; + + Real x217 = X(10)*((X(4))*(X(4))); + + Real x218 = X(4)*x198*x5/((1.0 + 10000.0*std::exp(-600.0/(Tdust + 9.9999999999999993e-41)))*(7.9999999999999996e-6*x2 + x3 + 0.040000000000000001*std::sqrt(Tdust + x1))); + + Real x219 = 1.1194685000500219e-20*std::pow(x1, 2.7400000000000002)*std::exp(-4740.0*x52) + 1.0e-99; + + Real x220 = X(10)*X(20); + + Real x221 = 2.1555555555555562e-20*((x1)*(x1)*(x1))*std::exp(-4045.0*x52) + 1.0e-99; + + Real x222 = X(23)*X(4); + + Real x223 = x219*x220 - x221*x222; + + Real x224 = 1.9643512449766835e-11*std::pow(x1, 0.17000000000000001)*std::exp(-6400.0*x52) + 1.0e-99; + + Real x225 = X(10)*X(19); + + Real x226 = 1.0e-99 + 1.0e-10*std::exp(-7600.0*x52); + + Real x227 = X(20)*X(4); + + Real x228 = x224*x225 - x226*x227; + + Real x229 = 2.1999999999999999e-10*X(19)*X(4); + + Real x230 = 1.0e-99 + 5.4599999999999998e-10*std::exp(-1943.0*x52); + + Real x231 = X(10)*X(18); + + Real x232 = -x229 + x230*x231; + + Real x233 = 1.69e-9*X(10)*X(21); + + Real x234 = x169*x170 + x170*x171 + x233; + + Real x235 = 1.0e-13*X(25)*X(30); + + Real x236 = 1.0e-99 + 2.54e-10*std::exp(-13300.0*x52); + + Real x237 = X(33)*X(4); + + Real x238 = x235 - x236*x237; + + Real x239 = 6.1739095063118665e-10*std::pow(x1, 0.40999999999999998) + 1.0e-99; + + Real x240 = -x239; + + Real x241 = -x105; + + Real x242 = x106*x240 + x106*x241 + x107*x239; + + Real x243 = 1.0e-99 + 6.6399999999999998e-10*std::exp(-11700.0*x52); + + Real x244 = X(10)*X(17); + + Real x245 = 1.0e-99 + 1.3100000000000001e-10*std::exp(-80.0*x52); + + Real x246 = X(18)*X(4); + + Real x247 = x243*x244 - x245*x246; + + Real x248 = 1.01e-9*X(10)*X(24); + + Real x249 = x149*x150 + x150*x152 + x248; + + Real x250 = x157*x162 + x158*x160 - x161*x162; + + Real x251 = -x178 + x182*x183; + + Real x252 = -x173*x174 + x175*x176; + + Real x253 = -x130*x131 + x132*x133 + x133*x134; + + Real x254 = ((x148) ? ( + 1.371e-8 +) +: ( + 0 +)) + 1.0e-99; + + Real x255 = X(16)*X(25); + + Real x256 = ((x151) ? ( + 4.1551773299893819e-8*x78 + 5.673e-10 +) +: ( + 0 +)) + 1.0e-99; + + Real x257 = -x129 + x254*x255 + x255*x256; + + Real x258 = ((x1 <= 1167.4796423742259) ? ( + std::pow(10, 5.8888600000000002*x139 + 7.1969200000000004*x142 + 2.2506900000000001*x185 - 56.473700000000001 - 2.1690299999999998*x180/((((x137)*(x137)))*(((x137)*(x137)))) + 0.31788699999999998*x181/((x137)*(x137)*(x137)*(x137)*(x137))) +) +: ( + 0 +)) + 1.0e-99; + + Real x259 = X(10)*X(7); + + Real x260 = ((x1 > 1167.4796423742259) ? ( + 3.1699999999999999e-10*std::exp(-5207.0*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x261 = ((x1 > 200.0) ? ( + 5.25e-11*std::exp(-4430.0*x52 + 173900.0/x2) +) +: ( + 0 +)) + 1.0e-99; + + Real x262 = X(12)*X(4); + + Real x263 = x258*x259 + x259*x260 - x261*x262; + + Real x264 = 3.5999999999999998e-16*std::pow(T, 1.52)*std::exp(-1740.0*x52) + 1.0e-99; + + Real x265 = X(10)*X(25); + + Real x266 = 6.3600000000000002e-14*x1*std::exp(-9610.0*x52) + 1.0e-99; + + Real x267 = X(27)*X(4); + + Real x268 = x264*x265 - x266*x267 + x80*x81; + + Real x269 = ((x1 <= 150.0) ? ( + 4.9970000000000003e-11 +) +: ( + 0 +)) + 1.0e-99; + + Real x270 = X(22)*X(25); + + Real x271 = ((x1 > 150.0) ? ( + 2.4000000000000001e-11*std::exp(110.0*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x272 = 1.0e-99 + 3.1319999999999996e-10*std::exp(-8156.0*x52); + + Real x273 = X(32)*X(4); + + Real x274 = x269*x270 + x270*x271 - x272*x273; + + Real x275 = x118*x66 - x119*x73 - x72*x73 - x73*x76; + + Real x276 = -x164*x165 + x166*x167; + + Real x277 = ((x148) ? ( + 7.0509999999999997e-11 +) +: ( + 0 +)) + 1.0e-99; + + Real x278 = X(17)*X(25); + + Real x279 = ((x151) ? ( + 1.5557027645121538e-10*std::pow(x1, -0.33900000000000002)*std::exp(-0.108*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x280 = 1.0e-99 + 1.02e-10*std::exp(-914.0*x52); + + Real x281 = X(18)*X(22); + + Real x282 = x277*x278 + x278*x279 + x280*x281; + + Real x283 = 1.0e-25*X(4)*X(7); + + Real x284 = x124*x125 + x17*x18 - x283; + + Real x285 = 1.0e-99 + 1.46e-12*std::exp(-9650.0*x52); + + Real x286 = X(10)*X(22); + + Real x287 = ((x1 > 280.0) ? ( + 5.4499999999999998e-17 +) +: ( + 0 +)) + 1.0e-99; + + Real x288 = X(25)*X(4); + + Real x289 = ((x1 <= 280.0) ? ( + 8.1009819130659227e-21*std::pow(x1, 2.7999999999999998)*std::exp(-1950.0*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x290 = x285*x286 - x287*x288 - x288*x289 + x83*x84; + + Real x291 = 8.648509591313017e-18*std::pow(x1, -0.38) + 1.0e-99; + + Real x292 = X(22)*X(4); + + Real x293 = x20*x21 - x291*x292; + + Real x294 = 4.9999999999999996e-6*x10 + 1.0e-99; + + Real x295 = X(5)*X(8); + + Real x296 = x202*(6.0000000000000001e-32*x51 + 2.0000000000000002e-31*x78 + 1.0e-99) + x215*(-x209 - x214 - 3.0000000000000001e-99) + x294*x295; + + Real x297 = -x294*x295; + + Real x298 = x106*x239 + x107*x240 + x107*x241; + + Real x299 = X(6)*X(9); + + Real x300 = x299*(-9.8726896031426014e-7*x78 - 1.0e-99); + + Real x301 = -x143*x144 + x145*x146; + + Real x302 = -x258*x259 - x259*x260 + x261*x262; + + Real x303 = -x248; + + Real x304 = 1.6974097914175e-15*x77*std::exp(-7550.0*x52) + 1.0e-99; + + Real x305 = X(10)*X(33); + + Real x306 = -x304*x305; + + Real x307 = -x191; + + Real x308 = -x233; + + Real x309 = -x219*x220 + x221*x222; + + Real x310 = -x224*x225 + x226*x227; + + Real x311 = x229 - x230*x231; + + Real x312 = X(10)*x193; + + Real x313 = -x243*x244 + x245*x246 - x312; + + Real x314 = -x264*x265 + x266*x267; + + Real x315 = -x285*x286 + x287*x288 + x288*x289 + x84*x85; + + Real x316 = X(17)*X(31); + + Real x317 = 5.2000000000000001e-11*x316; + + Real x318 = X(16)*X(32); + + Real x319 = x317 - 7.9500000000000005e-10*x318; + + Real x320 = -x254*x255 - x255*x256; + + Real x321 = ((x1 <= 300.0) ? ( + 2.5000000000000002e-18 +) +: ( + 0 +)) + 1.0e-99; + + Real x322 = X(16)*X(22); + + Real x323 = ((x1 > 300.0) ? ( + 7.3875058242066447e-18*x188*std::exp(-68.0*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x324 = -x321*x322 - x322*x323; + + Real x325 = -1.04e-10*x316; + + Real x326 = x40*x41; + + Real x327 = ((x1 <= 1052.0) ? ( + 3.2682787072746432e-10*x58 +) +: ( + 0 +)) + 1.0e-99; + + Real x328 = X(17)*X(32); + + Real x329 = ((x1 > 1052.0) ? ( + 3.7991369449339675e-16*std::pow(x1, 1.54)*std::exp(613.0*x52) +) +: ( + 0 +)) + 1.0e-99; + + Real x330 = -x327*x328 - x328*x329; + + Real x331 = -x277*x278 - x278*x279; + + Real x332 = -x280*x281; + + Real x333 = 4.5299999999999999e-10*x318; + + Real x334 = ((X(25))*(X(25))); + + Real x335 = std::pow(x1, 1.1399999999999999)*std::exp(-50.0*x52); + + Real x336 = x334*(2.4749459212614312e-15*x335 + 1.0e-99); + + Real x337 = ((X(22))*(X(22))); + + Real x338 = std::pow(x1, 1.5800000000000001); + + Real x339 = 1.0e-99 + 2.8e-11*std::exp(-26500.0*x52); + + Real x340 = X(22)*X(33); + + Real x341 = 1.0e-99 + 4.1999999999999999e-12*std::exp(-24000.0*x52); + + Real x342 = X(30)*X(32); + + Real x343 = -x339*x340 + x341*x342; + + Real x344 = x317 + 3.4200000000000001e-10*x318; + + Real x345 = x327*x328 + x328*x329; + + Real x346 = -x269*x270 - x270*x271 + x272*x273; + + Real x347 = -x235 + x236*x237; + + Real x348 = x304*x305; + + Real x349 = x339*x340 - x341*x342; + + ydot(1) = X(30)*x7 - x0; + + ydot(2) = X(27)*x9 - x8; + + ydot(3) = x104 + x108 + x113 + x117 + x120 + x123 + x13 + x16 + x19 + x22 + x34*(8.7048158229535104e-117*x32 + 2.0e-99) + x35 + x39 + x42 + x45*(7.5807998548789035e-18*x43 + 2.0e-99) + x46 + x49 + x56*(2.6047246489532126e-6*x54 + 2.0e-99) + x57 + x62*(4.2024322823973014e-6*x60 + 2.0e-99) + x63 + x65*x66 + x68*(7.7143746719362896e-209*x67 + 2.0e-99) + x70*(1.1816487727453014e-69*x69 + 2.0e-99) + x72*x73 + x73*x76 + x82 + x86 + x92 + x97; + + ydot(4) = x117 + x121*x70 + x126 + x128 + x129 + x135 + x147 + x153 + x155 + x163 + x168 + x172 + x177 + x184 + x190; + + ydot(5) = x114*x115 + x115*x116 + x123 + x127 + x190 + x191 + x192 + x195 + x196*x201 + x202*(-1.8e-31*x51 - 6.0000000000000005e-31*x78 - 3.0000000000000001e-99) + x215*(3*x209 + 3*x214 + 9.0000000000000006e-99) - x216*x217 - 5.9999999999999997e-18*x218 + x223 + x228 + x232 + x234 + x238 + x242 + x247 + x249 + x250 + x251 + x252 + x253 + x257 + x263 + x268 + x274 + x275 + x276 + x282 + x284 + x290 + x293 + x296 + x44*x45 + x66*(8.7599999999999997e-10*x64 + 2.0e-99) + x73*(2*x71 + 2.0e-99) + x73*(2*x75 + 2.0e-99) + x80*(8.9373821670554065e-6*x78 + 2.0e-99) + x89*(2*x88 + 2.0e-99) + x91*(2*x154 + 2.0e-99); + + ydot(6) = x122*x70 + x155 + x275 + x297 + x298 + x46; + + ydot(7) = x250 + x300 + x301 + x39; + + ydot(8) = x163 + x284 + x298 + x299*(1.9745379206285203e-6*x78 + 2.0e-99) + x302 + x37*x38 + x49; + + ydot(9) = x186*x187 + x187*x189 + x251 + x297 + x92; + + ydot(10) = x126 + x242 + x300 + x47*x48; + + ydot(11) = x120 + x184 - x196*x201 + x196*(x200 + 1.0e-99) + x216*x217 + x217*(-7.5000000000000001e-33*x51 - 2.5000000000000002e-32*x78 - 1.0e-99) + 2.9999999999999998e-18*x218 + x296 + x301 + x302 + x303 + x306 + x307 + x308 + x309 + x310 + x311 + x313 + x314 + x315; + + ydot(12) = x156*x158 + x156*x162 + x19 + x192; + + ydot(13) = x108 + x147 + x263 + x283; + + ydot(14) = x103*x68 + x13; + + ydot(15) = x104 + x11*x12 + x253 + x33*x34; + + ydot(16) = x100*x68 + x102*x68 + x135 + x35; + + ydot(17) = x113 + x276 + x319 + x320 + x324 + x55*x56; + + ydot(18) = x109*x110 + x110*x111 + x110*x112 + x168 + x195 + x313 + x325 + x326 + x330 + x331 + x57; + + ydot(19) = x194 + x247 + x311 + x332; + + ydot(20) = x232 + x310 + x312; + + ydot(21) = x228 + x309; + + ydot(22) = x252 + x308 + x333 + x61*x62 + x97; + + ydot(23) = x15*(2.1137298733407573e-5*x14 + 2.0e-99) + x177 + x293 + x315 + x324 + x326 + x332 + x336 + x337*(-1.1950181274729681e-23*x338 - 2.0e-99) + x343 + x344 + x345 + x346 + x63 + x93*x94 + x94*x96; + + ydot(24) = x223; + + ydot(25) = x22 + x234 + x303; + + ydot(26) = x172 + x290 + x291*x292 + x314 + x320 + x331 + x334*(-4.9498918425228625e-15*x335 - 2.0e-99) + x346 + x347 + x79*x80; + + ydot(27) = x249 + x307 + x86; + + ydot(28) = -X(27)*x9 + x153 + x268 + x336 + x348 + x8; + + ydot(29) = x191 + x82; + + ydot(30) = x257 + x321*x322 + x322*x323 + x344 + x42; + + ydot(31) = -X(30)*x7 + x0 + x129 + x282 + x333 + x345 + x347 + x348 + x349; + + ydot(32) = x127 + x16 + x325; + + ydot(33) = x128 + x274 + x319 + x330 + x337*(5.9750906373648406e-24*x338 + 1.0e-99) + x349; + + ydot(34) = x238 + x306 + x343; + + + +} + + +AMREX_GPU_HOST_DEVICE AMREX_INLINE +Real rhs_eint(const burn_t& state, + const Array1D& X, + Real const /*user_crate*/, Real const /*user_Av*/, + Real const /*user_ionH*/, Real const /*user_ionH2*/, + Real const /*user_dissH2*/, Real const /*user_ionC*/, + Real const /*user_ionO*/, Real const /*user_dissCO*/, + Real const user_dust2gas_ratio, Real const Tdust, + Real const dustSemenov_cooling, Real const z, Real const Z) { + + using namespace Rates; + + Real T = state.T; + Real x0 = 3.3470650363800003e-24*X(10) + 5.0186540981899997e-24*X(11) + 5.01956503638e-24*X(12) + 6.6902431600000005e-24*X(13) + 6.6911540981899994e-24*X(14) + 6.6920650363799998e-24*X(15) + 2.007528417094e-23*X(16) + 2.0076195109127999e-23*X(17) + 2.1749727627315999e-23*X(18) + 2.3423260145503998e-23*X(19) + 9.1093818800000008e-28*X(2) + 2.5096792663692001e-23*X(20) + 2.6767349207315999e-23*X(21) + 2.6768260145504001e-23*X(22) + 2.6770325181879997e-23*X(23) + 2.8440881725504001e-23*X(24) + 2.8441792663692003e-23*X(25) + 3.0114414243691998e-23*X(26) + 3.011532518188e-23*X(27) + 3.178794676188e-23*X(28) + 4.6843544316443998e-23*X(29) + 1.6726215800000001e-24*X(3) + 4.6844455254632e-23*X(30) + 5.3535609352819999e-23*X(31) + 5.3536520291008001e-23*X(32) + 7.3612715400136001e-23*X(33) + 1.6735325181900001e-24*X(4) + 1.6744434563800001e-24*X(5) + 3.3451215800000003e-24*X(6) + 3.3460325181899999e-24*X(7) + 3.3461540981899999e-24*X(8) + 3.3469434563800003e-24*X(9); + + Real x1 = 1.0/x0; + + Real x2 = X(14) + X(3) + X(6); + + Real x3 = 2.73*z + 2.73; + + Real x4 = std::max(T, x3); + + Real x5 = std::sqrt(x4); + + Real x6 = 1.0/x4; + + Real x7 = 7.1777505408000004e-12*X(10); + + Real x8 = T <= 10 && x3 <= 10; + + Real x9 = T >= x3; + + Real x10 = z + 1; + + Real x11 = X(14)*X(2); + + Real x12 = ((x8) ? ( + 1.0/10.0 +) +: ((x9) ? ( + 1.0/T +) +: ( + 1.0/x3 +))); + + Real x13 = std::sqrt(T); + + Real x14 = std::sqrt(x10); + + Real x15 = 1.6522711641858305*x14; + + Real x16 = ((x8) ? ( + std::sqrt(10) +) +: ((x9) ? ( + x13 +) +: ( + x15 +))); + + Real x17 = 1.0/(0.0031622776601683794*x16 + 1.0); + + Real x18 = X(2)*x17; + + Real x19 = X(4)*x18; + + Real x20 = X(2)*x16*((x8) ? ( + 0.63095734448019325 +) +: ((x9) ? ( + std::pow(T, -0.20000000000000001) +) +: ( + 0.81802668403695478*std::pow(x10, -0.20000000000000001) +)))/(6.3095734448019361e-5*((x8) ? ( + 5.011872336272722 +) +: ((x9) ? ( + std::pow(T, 0.69999999999999996) +) +: ( + 2.0198255098866533*std::pow(x10, 0.69999999999999996) +))) + 1.0); + + Real x21 = x11*x17; + + Real x22 = X(14)*((X(2))*(X(2)))*x17*((x8) ? ( + 0.67810976749343443 +) +: ((x9) ? ( + std::pow(T, -0.16869999999999999) +) +: ( + 0.8441494880969781*std::pow(x10, -0.16869999999999999) +))); + + Real x23 = 1.0/x5; + + Real x24 = X(11) + X(12) + X(18) + X(24) + X(25) + X(5); + + Real x25 = 2.0*X(10) + 2.0*X(19) + 3.0*X(20) + 4.0*X(23) + 2.0*X(26) + 2.0*X(27) + 3.0*X(28) + X(3) + X(4) + 2.0*X(8) + x24; + + Real x26 = 1.0/x25; + + Real x27 = ((x4)*(x4)); + + Real x28 = 1.0/(1000000.0*x23*x26/(1.3999999999999999*X(10)*x26*std::exp(-12000.0/(x4 + 1200.0)) + 1.6000000000000001*X(4)*x26*std::exp(-160000.0/x27)) + 1.0); + + Real x29 = std::pow(x4, -0.25); + + Real x30 = std::log(T); + + Real x31 = M_LN10; + + Real x32 = 1.0/x31; + + Real x33 = std::exp((-2)*std::log(std::abs(x31))); + + Real x34 = 1.0/(std::pow(10.0, 1.3*x32*(x30 - 9.2103403719761836) - 137.42519902360013*x33*((0.10857362047581294*x30 - 1)*(0.10857362047581294*x30 - 1)) - 4.8449999999999998)*x25 + 1.0); + + Real x35 = std::sqrt(M_PI); + + Real x36 = std::log(std::min(10000000000.0, std::max(0.01, X(4)))); + + Real x37 = std::exp((-4)*std::log(std::abs(x31))); + + Real x38 = ((((x36)*(x36)))*(((x36)*(x36)))); + + Real x39 = amrex::Math::powi<-3>(x31); + + Real x40 = ((x36)*(x36)*(x36)); + + Real x41 = ((x36)*(x36)); + + Real x42 = std::log(std::min(10000.0, x4)); + + Real x43 = ((((x42)*(x42)))*(((x42)*(x42)))); + + Real x44 = ((x42)*(x42)*(x42)); + + Real x45 = ((x42)*(x42)); + + Real x46 = amrex::Math::powi<-5>(x31); + + Real x47 = std::exp((-8)*std::log(std::abs(x31))); + + Real x48 = amrex::Math::powi<-7>(x31); + + Real x49 = std::exp((-6)*std::log(std::abs(x31))); + + Real x50 = std::log(x4); + + Real x51 = ((x50)*(x50)*(x50)); + + Real x52 = x39*x51; + + Real x53 = 0.25820969999999999*x52; + + Real x54 = ((x50)*(x50)); + + Real x55 = x33*x54; + + Real x56 = std::log(27535.310000000001*x6 + 1.0); + + Real x57 = -2.4640089999999999*x32*x50 + 0.19859550000000001*x55 + 743.05999999999995*x6; + + Real x58 = std::exp(-0.0022727272727272726*x4); + + Real x59 = std::exp(-0.00054054054054054055*x4); + + Real x60 = 2.9375070000000001*x58 + 0.23588480000000001*x59 + 0.75022860000000002; + + Real x61 = x32*x50; + + Real x62 = 4.6331670000000003*x52; + + Real x63 = std::log(40870.379999999997*x6 + 1.0); + + Real x64 = -4.8909149999999997*x32*x50 + 0.47490300000000002*x55 - 133.82830000000001*x6; + + Real x65 = -2.0563129999999998*x58 + 0.58640729999999996*x59 + 0.82274429999999998; + + Real x66 = x0 >= 0.5; + + Real x67 = 1.0000420000000001*x32; + + Real x68 = x0 >= 9.9999999999999998e-13; + + Real x69 = ((x68) ? ( + std::pow(10.0, x67*std::log(((x66) ? ( + 0.5 + ) + : ( + x0 + ))) + 2.1498900000000001) +) +: ( + 0.0 +)); + + Real x70 = X(10) + X(4); + + Real x71 = X(0) + X(1) + X(13) + X(15) + X(16) + X(17) + X(19) + X(2) + X(20) + X(21) + X(22) + X(23) + X(26) + X(27) + X(28) + X(29) + X(30) + X(31) + X(32) + X(33) + X(7) + X(8) + X(9) + x2 + x24 + x70; + + Real x72 = x71 <= 9.9999999999999993e-41; + + Real x73 = x0 <= 9.9999999999999993e-41; + + Real x74 = std::pow(10.0, 2.1498900000000001 - 0.69317629274152892*x32); + + Real x75 = x0*x35; + + Real x76 = x13*x75; + + Real x77 = x74*x76; + + Real x78 = std::pow(10.0, x67*std::log(x0) + 2.1498900000000001); + + Real x79 = x76*x78; + + Real x80 = x14*x75; + + Real x81 = x74*x80; + + Real x82 = x78*x80; + + Real x83 = 0.045468571811084373*X(10) + 0.068176456620437725*X(11) + 0.068188831360114804*X(12) + 0.090884341429791085*X(13) + 0.09089671616946815*X(14) + 0.090909090909145243*X(15) + 0.27271489798762283*X(16) + 0.27272727272727271*X(17) + 0.29546155863278772*X(18) + 0.31819584453830274*X(19) + 1.2374739649915389e-5*X(2) + 0.34093013044381776*X(20) + 0.36362398889671371*X(21) + 0.36363636363636365*X(22) + 0.36366441634933278*X(23) + 0.38635827480222873*X(24) + 0.38637064954187872*X(25) + 0.40909256070774375*X(26) + 0.40910493544739368*X(27) + 0.43182684661325876*X(28) + 0.63635126162398636*X(29) + 0.0227219111658651*X(3) + 0.63636363636363635*X(30) + 0.7272603525330773*X(31) + 0.72727272727272729*X(32) + X(33) + 0.022734285905542186*X(4) + 0.022746660645219272*X(5) + 0.045442170714895543*X(6) + 0.045454545454572622*X(7) + 0.045456197071407287*X(8) + 0.045466920194249714*X(9); + + Real x84 = 1.0/std::fabs(x83); + + Real x85 = std::sqrt(x71); + + Real x86 = std::exp((-2)*std::log(std::abs(x83))); + + Real x87 = std::sqrt(x71*x86); + + Real x88 = 4.985670872372847e-33*std::pow(x4, 3.7599999999999998)*std::exp(-2197000.0/((x4)*(x4)*(x4)))/(6.0142468035272636e-8*std::pow(x4, 2.1000000000000001) + 1.0) + 1.6e-18*std::exp(-11700.0*x6) + 6.7e-19*std::exp(-5860.0*x6) + 3.0e-24*std::exp(-510.0*x6); + + Real x89 = x4 < 2000.0; + + Real x90 = x50 - 6.9077552789821368; + + Real x91 = 0.14476482730108395*x50 - 1; + + Real x92 = x33*((x91)*(x91)); + + Real x93 = ((x91)*(x91)*(x91)); + + Real x94 = x39*x93; + + Real x95 = ((((x91)*(x91)))*(((x91)*(x91)))); + + Real x96 = ((x91)*(x91)*(x91)*(x91)*(x91)); + + Real x97 = x49*std::exp((6)*std::log(std::abs(x91))); + + Real x98 = x48*((x91)*(x91)*(x91)*(x91)*(x91)*(x91)*(x91)); + + Real x99 = std::exp((8)*std::log(std::abs(x91))); + + Real x100 = std::pow(10, std::min(300.0, 5.0194035000000001*x32*x90 + 5627.2167698544854*x37*x95 + 86051.290034608537*x46*x96 + 9415777.8988952208*x47*x99 - 75.100986441619156*x92 - 1554.3387057364687*x94 - 428804.85473346239*x97 - 1662263.0320406025*x98 - 20.584225)); + + Real x101 = x4 <= 10000.0; + + Real x102 = 5.5313336794064847e-19/(std::exp(std::min(300.0, 0.00020000000000000001*x4 - 6.0)) + 1.0); + + Real x103 = ((x89) ? ( + x88 +) +: ((x101) ? ( + x100 +) +: ( + x102 +))); + + Real x104 = std::pow(x4, 25.0*x32); + + Real x105 = std::pow(10.0, -200.0 + 20000.0/((10.0 + 2.3538526683701997e+17/x104)*(1.6889118802245084e-48*x104 + 10.0))); + + Real x106 = x37*x95; + + Real x107 = x46*x96; + + Real x108 = std::pow(10, -339.5619991617852*x106 - 529.07725573213918*x107 + 2.0943374000000001*x32*x90 + 144.02112655888752*x39*x93 - 36.814414747418546*x92 - 23.962112000000001)*X(10)*x105; + + Real x109 = x32*x90; + + Real x110 = std::pow(10, -377.88183430702219*x106 + 3018.4974183098116*x107 + 2.1892372*x109 - 38.89917505778142*x92 + 95.70878894783884*x94 - 23.689236999999999)*X(15); + + Real x111 = x4 > 10.0; + + Real x112 = x101 && x111; + + Real x113 = std::pow(x4, 16.666666666666664*x32); + + Real x114 = std::pow(10.0, -200.0 + 20000.0/((10.0 + 785.77199422741614/x113)*(5.0592917094448065e-34*x113 + 10.0))); + + Real x115 = 1.002560385050777e-22*X(15)*x114; + + Real x116 = std::pow(10, -1161.2797752309887*x106 + 5059.6285287169567*x107 + 1.5714710999999999*x109 + 0.73442154540113413*x92 - 77.855706084264682*x94 - 22.089523)*X(3); + + Real x117 = 1.1825091393820599e-21*X(3)*x114; + + Real x118 = std::pow(10, 45902.322591745004*x106 + 60522.293708798054*x107 + 37.383713*x109 + 2774.5177117396752*x92 + 16037.924047681272*x94 - 16.818342000000001)*X(4); + + Real x119 = x4 <= 100.0; + + Real x120 = std::pow(10, -48562.751069188118*x106 - 66875.646562351845*x107 + 3.5692468000000002*x32*x90 - 540.77102118284597*x92 - 9179.8864335208946*x94 - 24.311209000000002)*X(4); + + Real x121 = x4 <= 1000.0; + + Real x122 = std::pow(10, -12547.661945180447*x106 + 24439.250555499191*x107 + 4.6450521*x109 - 177.55453097873294*x92 + 1956.911370108365*x94 - 24.311209000000002)*X(4); + + Real x123 = x4 <= 6000.0; + + Real x124 = std::pow(x4, 17.997580222853362*x32); + + Real x125 = 1.8623144679125181e-22*std::pow(10.0, -200.0 + 20000.0/((10.0 + 2973.7534532281375/x124)*(1.3368457736780898e-34*x124 + 10.0)))*X(4); + + Real x126 = x47*x99; + + Real x127 = std::pow(10, std::min(300.0, 1672890.7229183144*x106 + 15471651.937466398*x107 + 16.815729999999999*x109 + 366063607.58415633*x126 + 4616.3011562659685*x92 + 113122.17137872758*x94 + 87115306.05744876*x97 + 273295393.17143697*x98 - 21.928795999999998))*X(2); + + Real x128 = x4 <= 500.0; + + Real x129 = x4 > 100; + + Real x130 = x128 && x129; + + Real x131 = std::pow(10, -10763.919849753534*x106 - 138531.11016116844*x107 + 1.6802758*x109 - 33025002.640084207*x126 + 44.525106942242758*x92 + 1331.8748828877385*x94 + 968783.44101153011*x97 + 4831859.3594864924*x98 - 22.921188999999998)*X(2); + + Real x132 = x4 > 500.0; + + Real x133 = x105*((x130) ? ( + x127 +) +: ((x132) ? ( + x131 +) +: ( + 0 +))) + x108 + ((x112) ? ( + x110 +) +: ( + x115 +)) + ((x112) ? ( + x116 +) +: ( + x117 +)) + ((x119) ? ( + x118 +) +: ((x121) ? ( + x120 +) +: ((x123) ? ( + x122 +) +: ( + x125 +)))); + + Real x134 = x88 >= 1.0e-99; + + Real x135 = x105*x127; + + Real x136 = x108 + x118; + + Real x137 = x110 + x116; + + Real x138 = x136 + x137; + + Real x139 = x135 + x138 >= 1.0e-99; + + Real x140 = x108 + x137; + + Real x141 = x120 + x140; + + Real x142 = x135 + x141 >= 1.0e-99; + + Real x143 = x122 + x140; + + Real x144 = x135 + x143 >= 1.0e-99; + + Real x145 = x125 + x140; + + Real x146 = x135 + x145 >= 1.0e-99; + + Real x147 = x115 + x117; + + Real x148 = x136 + x147; + + Real x149 = x135 + x148 >= 1.0e-99; + + Real x150 = x108 + x147; + + Real x151 = x120 + x150; + + Real x152 = x135 + x151 >= 1.0e-99; + + Real x153 = x122 + x150; + + Real x154 = x135 + x153 >= 1.0e-99; + + Real x155 = x125 + x150; + + Real x156 = x135 + x155 >= 1.0e-99; + + Real x157 = x105*x131; + + Real x158 = x138 + x157 >= 1.0e-99; + + Real x159 = x141 + x157 >= 1.0e-99; + + Real x160 = x143 + x157 >= 1.0e-99; + + Real x161 = x145 + x157 >= 1.0e-99; + + Real x162 = x148 + x157 >= 1.0e-99; + + Real x163 = x151 + x157 >= 1.0e-99; + + Real x164 = x153 + x157 >= 1.0e-99; + + Real x165 = x155 + x157 >= 1.0e-99; + + Real x166 = x138 >= 1.0e-99; + + Real x167 = x141 >= 1.0e-99; + + Real x168 = x143 >= 1.0e-99; + + Real x169 = x145 >= 1.0e-99; + + Real x170 = x148 >= 1.0e-99; + + Real x171 = x151 >= 1.0e-99; + + Real x172 = x153 >= 1.0e-99; + + Real x173 = x155 >= 1.0e-99; + + Real x174 = x100 >= 1.0e-99; + + Real x175 = x102 >= 1.0e-99; + + Real x176 = 1.0/(1 + 91635868.75882785*std::exp(-0.00066666666666666675*x4)); + + Real x177 = x32*std::log(T); + + Real x178 = x177 >= 4.0 && x177 <= 4.02118929906994; + + Real x179 = x177 >= 4.02118929906994 && x177 <= 4.0413926851582298; + + Real x180 = x177 >= 4.0413926851582298 && x177 <= 4.0644579892269199; + + Real x181 = x177 >= 4.0644579892269199 && x177 <= 4.0863598306747502; + + Real x182 = x177 >= 4.0863598306747502 && x177 <= 4.1072099696478697; + + Real x183 = x177 >= 4.1072099696478697 && x177 <= 4.1271047983648099; + + Real x184 = x177 >= 4.1271047983648099 && x177 <= 4.1492191126553797; + + Real x185 = x177 >= 4.1492191126553797 && x177 <= 4.1702617153949602; + + Real x186 = x177 >= 4.1702617153949602 && x177 <= 4.1903316981702901; + + Real x187 = x177 >= 4.1903316981702901 && x177 <= 4.2121876044039599; + + Real x188 = x177 >= 4.2121876044039599 && x177 <= 4.2329961103921496; + + Real x189 = x177 >= 4.2329961103921496 && x177 <= 4.25527250510331; + + Real x190 = x177 >= 4.25527250510331 && x177 <= 4.2764618041732403; + + Real x191 = x177 >= 4.2764618041732403 && x177 <= 4.2988530764097099; + + Real x192 = x177 >= 4.2988530764097099 && x177 <= 4.3201462861110498; + + Real x193 = x177 >= 4.3201462861110498 && x177 <= 4.3424226808222102; + + Real x194 = x177 >= 4.3424226808222102 && x177 <= 4.3636119798921396; + + Real x195 = x177 >= 4.3636119798921396 && x177 <= 4.3856062735983103; + + Real x196 = x177 >= 4.3856062735983103 && x177 <= 4.40823996531185; + + Real x197 = x177 >= 4.40823996531185 && x177 <= 4.4297522800024103; + + Real x198 = x177 >= 4.4297522800024103 && x177 <= 4.4517864355242898; + + Real x199 = x177 >= 4.4517864355242898 && x177 <= 4.4742162640762597; + + Real x200 = x177 >= 4.4742162640762597 && x177 <= 4.4969296480732197; + + Real x201 = x177 >= 4.4969296480732197 && x177 <= 4.5185139398778897; + + Real x202 = x177 >= 4.5185139398778897 && x177 <= 4.5403294747908696; + + Real x203 = x177 >= 4.5403294747908696 && x177 <= 4.5622928644564702; + + Real x204 = x177 >= 4.5622928644564702 && x177 <= 4.5843312243675296; + + Real x205 = x177 >= 4.5843312243675296 && x177 <= 4.6063813651106003; + + Real x206 = x177 >= 4.6063813651106003 && x177 <= 4.6294095991027202; + + Real x207 = x177 >= 4.6294095991027202 && x177 <= 4.65127801399814; + + Real x208 = x177 >= 4.65127801399814 && x177 <= 4.6730209071289002; + + Real x209 = x177 >= 4.6730209071289002 && x177 <= 4.6954816764901999; + + Real x210 = x177 >= 4.6954816764901999 && x177 <= 4.7176705030022603; + + Real x211 = x177 >= 4.7176705030022603 && x177 <= 4.7395723444500897; + + Real x212 = x177 >= 4.7395723444500897 && x177 <= 4.7619278384205304; + + Real x213 = x177 >= 4.7619278384205304 && x177 <= 4.7839035792727396; + + Real x214 = x177 >= 4.7839035792727396 && x177 <= 4.8061799739838902; + + Real x215 = x177 >= 4.8061799739838902 && x177 <= 4.8286598965353198; + + Real x216 = x177 >= 4.8286598965353198 && x177 <= 4.8506462351830697; + + Real x217 = x177 >= 4.8506462351830697 && x177 <= 4.87273882747267; + + Real x218 = x177 >= 4.87273882747267 && x177 <= 4.8954225460394101; + + Real x219 = x177 >= 4.8954225460394101 && x177 <= 4.9175055095525497; + + Real x220 = x177 >= 4.9175055095525497 && x177 <= 4.93951925261862; + + Real x221 = x177 >= 4.93951925261862 && x177 <= 4.96189547366785; + + Real x222 = x177 >= 4.96189547366785 && x177 <= 4.98407703390283; + + Real x223 = x177 >= 4.98407703390283 && x177 <= 5.0086001717619197; + + Real x224 = x177 >= 5.0086001717619197 && x177 <= 5.0293837776852097; + + Real x225 = x177 >= 5.0293837776852097 && x177 <= 5.0492180226701802; + + Real x226 = x177 >= 5.0492180226701802 && x177 <= 5.0718820073061304; + + Real x227 = x177 >= 5.0718820073061304 && x177 <= 5.0934216851622303; + + Real x228 = x177 >= 5.0934216851622303 && x177 <= 5.11727129565576; + + Real x229 = x177 >= 5.11727129565576 && x177 <= 5.1398790864012396; + + Real x230 = x177 >= 5.1398790864012396 && x177 <= 5.1613680022349797; + + Real x231 = x177 >= 5.1613680022349797 && x177 <= 5.1846914308176002; + + Real x232 = x177 >= 5.1846914308176002 && x177 <= 5.20682587603185; + + Real x233 = x177 >= 5.20682587603185 && x177 <= 5.2278867046136703; + + Real x234 = x177 >= 5.2278867046136703 && x177 <= 5.2504200023088901; + + Real x235 = x177 >= 5.2504200023088901 && x177 <= 5.2741578492636796; + + Real x236 = x177 >= 5.2741578492636796 && x177 <= 5.29666519026153; + + Real x237 = x177 >= 5.29666519026153 && x177 <= 5.3180633349627602; + + Real x238 = x177 >= 5.3180633349627602 && x177 <= 5.3404441148401203; + + Real x239 = x177 >= 5.3404441148401203 && x177 <= 5.3617278360175904; + + Real x240 = x177 >= 5.3617278360175904 && x177 <= 5.3838153659804302; + + Real x241 = x177 >= 5.3838153659804302 && x177 <= 5.4065401804339599; + + Real x242 = x177 >= 5.4065401804339599 && x177 <= 5.4297522800024103; + + Real x243 = x177 >= 5.4297522800024103 && x177 <= 5.4517864355242898; + + Real x244 = x177 >= 5.4517864355242898 && x177 <= 5.4742162640762597; + + Real x245 = x177 >= 5.4742162640762597 && x177 <= 5.4955443375464501; + + Real x246 = x177 >= 5.4955443375464501 && x177 <= 5.5185139398778897; + + Real x247 = x177 >= 5.5185139398778897 && x177 <= 5.5403294747908696; + + Real x248 = x177 >= 5.5403294747908696 && x177 <= 5.5634810853944101; + + Real x249 = x177 >= 5.5634810853944101 && x177 <= 5.5854607295085001; + + Real x250 = x177 >= 5.5854607295085001 && x177 <= 5.60745502321467; + + Real x251 = x177 >= 5.60745502321467 && x177 <= 5.6294095991027202; + + Real x252 = x177 >= 5.6294095991027202 && x177 <= 5.6522463410033197; + + Real x253 = x177 >= 5.6522463410033197 && x177 <= 5.6739419986340902; + + Real x254 = x177 >= 5.6739419986340902 && x177 <= 5.6963563887333297; + + Real x255 = x177 >= 5.6963563887333297 && x177 <= 5.7185016888672697; + + Real x256 = x177 >= 5.7185016888672697 && x177 <= 5.7411515988517898; + + Real x257 = x177 >= 5.7411515988517898 && x177 <= 5.7634279935629404; + + Real x258 = x177 >= 5.7634279935629404 && x177 <= 5.7853298350107698; + + Real x259 = x177 >= 5.7853298350107698 && x177 <= 5.8082109729242202; + + Real x260 = x177 >= 5.8082109729242202 && x177 <= 5.8299466959416399; + + Real x261 = x177 >= 5.8299466959416399 && x177 <= 5.8524799936368597; + + Real x262 = x177 >= 5.8524799936368597 && x177 <= 5.8744818176994702; + + Real x263 = x177 >= 5.8744818176994702 && x177 <= 5.8970770032094197; + + Real x264 = x177 >= 5.8970770032094197 && x177 <= 5.9190780923760702; + + Real x265 = x177 >= 5.9190780923760702 && x177 <= 5.9415114326343996; + + Real x266 = x177 >= 5.9415114326343996 && x177 <= 5.96378782734556; + + Real x267 = x177 >= 5.96378782734556 && x177 <= 5.98632377705077; + + Real x268 = x177 >= 5.98632377705077 && x177 <= 6.0086001717619197; + + Real x269 = x177 >= 6.0086001717619197 && x177 <= 6.0293837776852097; + + Real x270 = x177 >= 6.0293837776852097 && x177 <= 6.0530784434834199; + + Real x271 = x177 >= 6.0530784434834199 && x177 <= 6.0755469613925301; + + Real x272 = x177 >= 6.0755469613925301 && x177 <= 6.0969100130080598; + + Real x273 = x177 >= 6.0969100130080598 && x177 <= 6.1205739312058496; + + Real x274 = x177 >= 6.1205739312058496 && x177 <= 6.1430148002540896; + + Real x275 = x177 >= 6.1430148002540896 && x177 <= 6.1643528557844398; + + Real x276 = x177 >= 6.1643528557844398 && x177 <= 6.18752072083646; + + Real x277 = x177 >= 6.18752072083646 && x177 <= 6.2095150145426299; + + Real x278 = x177 >= 6.2095150145426299 && x177 <= 6.2304489213782697; + + Real x279 = x177 >= 6.2304489213782697 && x177 <= 6.2528530309798898; + + Real x280 = x177 >= 6.2528530309798898 && x177 <= 6.2764618041732403; + + Real x281 = x177 >= 6.2764618041732403 && x177 <= 6.2988530764097099; + + Real x282 = x177 >= 6.2988530764097099 && x177 <= 6.3201462861110498; + + Real x283 = x177 >= 6.3201462861110498 && x177 <= 6.3424226808222102; + + Real x284 = x177 >= 6.3424226808222102 && x177 <= 6.3654879848909003; + + Real x285 = x177 >= 6.3654879848909003 && x177 <= 6.3873898263387296; + + Real x286 = x177 >= 6.3873898263387296 && x177 <= 6.4099331233312897; + + Real x287 = x177 >= 6.4099331233312897; + + Real x288 = x177 >= 6.4313637641589896; + + Real x289 = x177 <= 6.4533183400470397; + + Real x290 = x177 <= 6.4313637641589896; + + Real x291 = x177 >= 6.4533183400470397 && x177 <= 6.47567118832443; + + Real x292 = x177 >= 6.47567118832443 && x177 <= 6.4983105537896; + + Real x293 = x177 >= 6.4983105537896 && x177 <= 6.5211380837040398; + + Real x294 = x177 >= 6.5211380837040398 && x177 <= 6.5428254269591797; + + Real x295 = x177 >= 6.5428254269591797 && x177 <= 6.5658478186735199; + + Real x296 = x177 >= 6.5658478186735199 && x177 <= 6.5877109650189096; + + Real x297 = x177 >= 6.5877109650189096 && x177 <= 6.6095944092252203; + + Real x298 = x177 >= 6.6095944092252203 && x177 <= 6.6324572921847196; + + Real x299 = x177 >= 6.6324572921847196 && x177 <= 6.6541765418779599; + + Real x300 = x177 >= 6.6541765418779599 && x177 <= 6.6766936096248699; + + Real x301 = x177 >= 6.6766936096248699 && x177 <= 6.6989700043360196; + + Real x302 = x177 >= 6.6989700043360196 && x177 <= 6.6998377258672503; + + Real x303 = x177 >= 6.6998377258672503 && x177 <= 6.7201593034059597; + + Real x304 = x177 >= 6.7201593034059597 && x177 <= 6.7403626894942397; + + Real x305 = x177 >= 6.7403626894942397 && x177 <= 6.7596678446896297; + + Real x306 = x177 >= 6.7596678446896297 && x177 <= 6.7803173121401503; + + Real x307 = x177 >= 6.7803173121401503 && x177 <= 6.8000293592441299; + + Real x308 = x177 >= 6.8000293592441299 && x177 <= 6.8202014594856397; + + Real x309 = x177 >= 6.8202014594856397 && x177 <= 6.8401060944567602; + + Real x310 = x177 >= 6.8401060944567602 && x177 <= 6.8597385661971497; + + Real x311 = x177 >= 6.8597385661971497 && x177 <= 6.8802417758954801; + + Real x312 = x177 >= 6.8802417758954801 && x177 <= 6.8998205024271; + + Real x313 = x177 >= 6.8998205024271 && x177 <= 6.92012332629072; + + Real x314 = x177 >= 6.92012332629072 && x177 <= 6.9400181550076603; + + Real x315 = x177 >= 6.9400181550076603 && x177 <= 6.95999483832842; + + Real x316 = x177 >= 6.95999483832842 && x177 <= 6.9800033715837504; + + Real x317 = x177 >= 6.9800033715837504 && x177 <= 7.0; + + Real x318 = x177 >= 7.0 && x177 <= 7.02118929906994; + + Real x319 = x177 >= 7.02118929906994 && x177 <= 7.0413926851582298; + + Real x320 = x177 >= 7.0413926851582298 && x177 <= 7.06069784035361; + + Real x321 = x177 >= 7.06069784035361 && x177 <= 7.0791812460476304; + + Real x322 = x177 >= 7.0791812460476304 && x177 <= 7.1003705451175598; + + Real x323 = x177 >= 7.1003705451175598 && x177 <= 7.1205739312058496; + + Real x324 = x177 >= 7.1205739312058496 && x177 <= 7.1398790864012396; + + Real x325 = x177 >= 7.1398790864012396 && x177 <= 7.1613680022349797; + + Real x326 = x177 >= 7.1613680022349797 && x177 <= 7.1789769472931697; + + Real x327 = x177 >= 7.1789769472931697 && x177 <= 7.1986570869544204; + + Real x328 = x177 >= 7.1986570869544204 && x177 <= 7.2201080880400497; + + Real x329 = x177 >= 7.2201080880400497 && x177 <= 7.2405492482826004; + + Real x330 = x177 >= 7.2405492482826004 && x177 <= 7.2600713879850796; + + Real x331 = x177 >= 7.2600713879850796 && x177 <= 7.2810333672477299; + + Real x332 = x177 >= 7.2810333672477299 && x177 <= 7.3010299956639804; + + Real x333 = x177 >= 7.3010299956639804 && x177 <= 7.3201462861110498; + + Real x334 = x177 >= 7.3201462861110498 && x177 <= 7.3404441148401203; + + Real x335 = x177 >= 7.3404441148401203 && x177 <= 7.3598354823398902; + + Real x336 = x177 >= 7.3598354823398902 && x177 <= 7.3802112417116099; + + Real x337 = x177 >= 7.3802112417116099 && x177 <= 7.3996737214810402; + + Real x338 = x177 >= 7.3996737214810402 && x177 <= 7.4199557484897598; + + Real x339 = x177 >= 7.4199557484897598 && x177 <= 7.4393326938302602; + + Real x340 = x177 >= 7.4393326938302602 && x177 <= 7.4593924877592297; + + Real x341 = x177 >= 7.4593924877592297 && x177 <= 7.4800069429571501; + + Real x342 = x177 >= 7.4800069429571501 && x177 <= 7.4996870826183999; + + Real x343 = x177 >= 7.4996870826183999 && x177 <= 7.5198279937757198; + + Real x344 = x177 >= 7.5198279937757198 && x177 <= 7.5403294747908696; + + Real x345 = x177 >= 7.5403294747908696 && x177 <= 7.5599066250361098; + + Real x346 = x177 >= 7.5599066250361098 && x177 <= 7.5797835966168101; + + Real x347 = x177 >= 7.5797835966168101 && x177 <= 7.5998830720736903; + + Real x348 = x177 >= 7.5998830720736903 && x177 <= 7.6201360549737602; + + Real x349 = x177 >= 7.6201360549737602 && x177 <= 7.6404814369704201; + + Real x350 = x177 >= 7.6404814369704201 && x177 <= 7.6599162000698504; + + Real x351 = x177 >= 7.6599162000698504 && x177 <= 7.6803355134145601; + + Real x352 = x177 >= 7.6803355134145601 && x177 <= 7.6998377258672503; + + Real x353 = x177 >= 7.6998377258672503 && x177 <= 7.7201593034059597; + + Real x354 = x177 >= 7.7201593034059597 && x177 <= 7.7403626894942397; + + Real x355 = x177 >= 7.7403626894942397 && x177 <= 7.7596678446896297; + + Real x356 = x177 >= 7.7596678446896297 && x177 <= 7.7803173121401503; + + Real x357 = x177 >= 7.7803173121401503 && x177 <= 7.8000293592441299; + + Real x358 = x177 >= 7.8000293592441299 && x177 <= 7.8202014594856397; + + Real x359 = x177 >= 7.8202014594856397 && x177 <= 7.8401060944567602; + + Real x360 = x177 >= 7.8401060944567602 && x177 <= 7.8597385661971497; + + Real x361 = x177 >= 7.8597385661971497 && x177 <= 7.8802417758954801; + + Real x362 = x177 >= 7.8802417758954801 && x177 <= 7.8998205024271; + + Real x363 = x177 >= 7.8998205024271 && x177 <= 7.92012332629072; + + Real x364 = x177 >= 7.92012332629072 && x177 <= 7.9400181550076603; + + Real x365 = x177 >= 7.9400181550076603 && x177 <= 7.95999483832842; + + Real x366 = x177 >= 7.95999483832842 && x177 <= 7.9800033715837504; + + Real x367 = x177 >= 7.9800033715837504 && x177 <= 8.0; + + Real x368 = user_dust2gas_ratio > 0; + + Real x369 = std::exp(-91.200000000000003*x6); + + Real x370 = std::max(0.0, X(2)); + + Real x371 = x23*x370; + + Real x372 = std::max(0.0, X(4)); + + Real x373 = x372*std::pow(x4, 0.070000000000000007); + + Real x374 = 5.6000000000000006e-6*x369*x371 + 1.1590975361199841e-9*x369*x373; + + Real x375 = 3.8e-6*x371 + 0.00017013; + + Real x376 = 7.7999999999999999e-6*x371*std::exp(-38574.400000000001*x6); + + Real x377 = 2.4999999999999998e-6*x371 + 1.3e-7; + + Real x378 = 5.2000000000000002e-6*x371*std::exp(-38603.199999999997*x6); + + Real x379 = 1.6666666666666665e-6*x371*std::exp(-28.800000000000001*x6); + + Real x380 = -1.3e-6*x371 - x379 - 5.1e-5; + + Real x381 = X(21)/(x376*(-x375 - x379) + x377*(-x378 + x379) + x380*(x375 + x378)); + + Real x382 = std::max(0.0, X(3)); + + Real x383 = x382*((x4 <= 2090.0) ? ( + 2.03e-11*std::pow(x4, 0.56000000000000005) +) +: ( + 3.43e-10*std::pow(x4, 0.19) +)); + + Real x384 = x372*std::pow(x4, 0.44); + + Real x385 = x370*std::pow(x4, 0.92600000000000005); + + Real x386 = x383 + 1.4500824124120476e-11*x384 + 1.08e-14*x385; + + Real x387 = x386 + 1.8e-5; + + Real x388 = std::exp(-330.0*x6); + + Real x389 = x370*std::pow(x4, -0.025999999999999999); + + Real x390 = 9.7199999999999998e-11*x388*x389; + + Real x391 = std::pow(x4, 0.80000000000000004); + + Real x392 = x372*x391; + + Real x393 = 2.160222331098239e-13*x388*x392; + + Real x394 = x382*((x4 <= 511.0) ? ( + 6.1000000000000003e-13*std::pow(x4, 1.1000000000000001) +) +: ((x4 <= 7510.0) ? ( + 2.1199999999999999e-12*std::pow(x4, 0.90000000000000002) +) +: ( + 4.49e-10*std::pow(x4, 0.29999999999999999) +))); + + Real x395 = 0.20000000000000001*x388*x394; + + Real x396 = x390 + x393 + x395; + + Real x397 = std::exp(-230.0*x6); + + Real x398 = x370*std::pow(x4, -0.074999999999999997); + + Real x399 = x372*std::pow(x4, 0.67000000000000004); + + Real x400 = x382*((x4 <= 194.0) ? ( + 6.3800000000000002e-11*std::pow(x4, 0.40000000000000002) +) +: ((x4 <= 3686.0) ? ( + 7.7500000000000007e-12*x391 +) +: ( + 2.6500000000000002e-10*std::pow(x4, 0.37) +))); + + Real x401 = 3.0719999999999998e-10*x397*x398 + 2.5231268066741097e-12*x397*x399 + 0.59999999999999998*x397*x400; + + Real x402 = x386 + 4.8599999999999998e-10*x389 + 1.0801111655491194e-12*x392 + x394 + 1.8000129999999999e-5; + + Real x403 = std::exp(-100.0*x6); + + Real x404 = 0.33333333333333331*x383*x403 + 4.8336080413734914e-12*x384*x403 + 3.6000000000000001e-15*x385*x403; + + Real x405 = -5.1199999999999999e-10*x398 - 4.2052113444568494e-12*x399 - x400 - x404 - 8.8999999999999995e-5; + + Real x406 = X(22)/(x387*(-x390 - x393 - x395 + x404) + x401*(-x402 - x404) + x405*(x396 + x402)); + + Real x407 = x372*std::pow(x4, 0.26000000000000001); + + Real x408 = std::max(0.0, 0.75*X(10)); + + Real x409 = std::exp(-0.0028661507595299516*x4); + + Real x410 = std::max(0.0, 0.25*X(10)); + + Real x411 = std::exp(-0.0079776625448743522*x4); + + Real x412 = std::exp(-0.0039888312724371761*x4); + + Real x413 = ((((x50)*(x50)))*(((x50)*(x50)))); + + Real x414 = x370*((x121) ? ( + 1.0173250550588591e-9*x23*std::exp(0.00235272*x413 - 0.57443*x50 - 0.041816600000000002*x51 + 0.35826400000000003*x54) +) +: ( + 9.0467979597705753e+161*x23*std::exp(0.097857299999999994*x413 - 202.19200000000001*x50 - 3.1926800000000002*x51 + 38.504899999999999*x54) +)); + + Real x415 = x4 <= 5000.0; + + Real x416 = x382*((x415) ? ( + std::pow(x4, 0.69999999999999996)*(1.7e-18*x27 - 2.2000000000000001e-14*x4 + 1.0e-10) +) +: ( + 9.1999999999999997e-9*std::pow(x4, 0.053499999999999999) +)); + + Real x417 = x408*(2.8999999999999998e-10 - 1.8999999999999999e-10*x409) + x410*(1.8e-10*x411 - 2.5999999999999998e-10*x412 + 2.7e-10) + x414 + x416; + + Real x418 = 8.7578599891658458e-11*x407 + x417 + 2.7000000000000001e-7; + + Real x419 = std::exp(-63.0*x6); + + Real x420 = 1.3891777913849274e-10*x407*x419; + + Real x421 = std::exp(-0.0025819777949909629*x4); + + Real x422 = x408*x419*(6.0e-10 - 3.0499999999999998e-10*x421); + + Real x423 = std::exp(-0.0089686098654708519*x4); + + Real x424 = std::exp(-0.0044843049327354259*x4); + + Real x425 = x410*x419*(4.35e-10*x423 - 4.3000000000000001e-10*x424 + 5.4999999999999996e-10); + + Real x426 = x382*((x415) ? ( + x4*(3.9000000000000001e-20*x27 - 5.9999999999999999e-16*x4 + 3.1000000000000001e-12) +) +: ( + 2.2999999999999999e-9*std::pow(x4, 0.096500000000000002) +)); + + Real x427 = 5.0*x419; + + Real x428 = x426*x427; + + Real x429 = x370*((x121) ? ( + 7.8546976572722417e-10*x23*std::exp(0.0070527699999999999*x413 - 1.3074300000000001*x50 - 0.11133800000000001*x51 + 0.69763799999999998*x54) +) +: ( + 3.2033184029538206e+146*x23*std::exp(0.093813800000000003*x413 - 187.47399999999999*x50 - 3.0328300000000001*x51 + 36.180300000000003*x54) +)); + + Real x430 = x427*x429; + + Real x431 = x420 + x422 + x425 + x428 + x430; + + Real x432 = std::exp(-24.0*x6); + + Real x433 = x372*std::pow(x4, 0.14000000000000001); + + Real x434 = std::exp(-0.01582278481012658*x4); + + Real x435 = std::exp(-0.0079113924050632899*x4); + + Real x436 = std::exp(-0.0091617040769583144*x4); + + Real x437 = std::exp(-0.0045808520384791572*x4); + + Real x438 = x382*((x415) ? ( + std::pow(x4, 0.45000000000000001)*(1.8999999999999999e-18*x27 - 1.7999999999999999e-14*x4 + 9.6000000000000005e-11) +) +: ( + 8.9000000000000003e-10*std::pow(x4, 0.11700000000000001) +)); + + Real x439 = 3.0*x432; + + Real x440 = x370*((x121) ? ( + 2.7641154276543743e-10*x23*std::exp(-0.00065632500000000003*x413 - 0.77378199999999997*x50 - 0.015089200000000001*x51 + 0.36118400000000001*x54) +) +: ( + 3.5214306661991335e+187*x23*std::exp(0.10508000000000001*x413 - 227.91300000000001*x50 - 3.4762*x51 + 42.594999999999999*x54) +)); + + Real x441 = x408*x432*(1.9800000000000001e-10*x436 - 1.9800000000000001e-10*x437 + 2.6099999999999998e-10) + x410*x432*(3.9e-10*x434 - 2.6099999999999998e-10*x435 + 2.3700000000000001e-10) + 2.5190758091989079e-10*x432*x433 + x438*x439 + x439*x440; + + Real x442 = 1.1536215571935701e-10*x407 + x408*(1.2e-10 - 6.0999999999999996e-11*x421) + x410*(8.6999999999999997e-11*x423 - 8.6e-11*x424 + 1.0999999999999999e-10) + x417 + x426 + x429 + 2.7000002100000003e-7; + + Real x443 = std::exp(-39.0*x6); + + Real x444 = 1.6666666666666667*x443; + + Real x445 = 1.459643331527641e-10*x407*x443 + x408*x443*(4.8333333333333332e-10 - 3.1666666666666666e-10*x409) + x410*x443*(3.0e-10*x411 - 4.3333333333333334e-10*x412 + 4.5e-10) + x414*x444 + x416*x444; + + Real x446 = -x408*(6.6000000000000005e-11*x436 - 6.6000000000000005e-11*x437 + 8.6999999999999997e-11) - x410*(1.2999999999999999e-10*x434 - 8.6999999999999997e-11*x435 + 7.8999999999999999e-11) - 8.3969193639963598e-11*x433 - x438 - x440 - x445 - 7.9000000000000006e-8; + + Real x447 = X(17)/(x418*(-x420 - x422 - x425 - x428 - x430 + x445) + x441*(-x442 - x445) + x446*(x431 + x442)); + + Real x448 = std::max(9.9999999999999993e-41, x70); + + Real x449 = x32*std::log(x448); + + Real x450 = std::min(11.999880000000001, x449); + + Real x451 = x450 < 2.0; + + Real x452 = std::min(2.9999700000000002, x61); + + Real x453 = x452 < 1.0; + + Real x454 = (1.0/2.0)*x50 - std::log(std::max(9.9999999999999993e-41, x0)) + (1.0/2.0)*std::log(std::max(9.9999999999999993e-41, x71)) - 10.69132076561309 + (1.0/2.0)*std::log(M_PI); + + Real x455 = std::min(18.99981, x32*(x454 + std::log(std::max(9.9999999999999993e-41, X(25))))); + + Real x456 = ((x450)*(x450)); + + Real x457 = ((x450)*(x450)*(x450)); + + Real x458 = ((((x450)*(x450)))*(((x450)*(x450)))); + + Real x459 = ((x450)*(x450)*(x450)*(x450)*(x450)); + + Real x460 = std::exp((6)*std::log(std::abs(x450))); + + Real x461 = ((x450)*(x450)*(x450)*(x450)*(x450)*(x450)*(x450)); + + Real x462 = std::exp((8)*std::log(std::abs(x450))); + + Real x463 = ((x450)*(x450)*(x450)*(x450)*(x450)*(x450)*(x450)*(x450)*(x450)); + + Real x464 = ((x452)*(x452)); + + Real x465 = ((x452)*(x452)*(x452)); + + Real x466 = ((((x452)*(x452)))*(((x452)*(x452)))); + + Real x467 = ((x452)*(x452)*(x452)*(x452)*(x452)); + + Real x468 = std::exp((6)*std::log(std::abs(x452))); + + Real x469 = ((x452)*(x452)*(x452)*(x452)*(x452)*(x452)*(x452)); + + Real x470 = std::exp((8)*std::log(std::abs(x452))); + + Real x471 = ((x452)*(x452)*(x452)*(x452)*(x452)*(x452)*(x452)*(x452)*(x452)); + + Real x472 = x450*x452; + + Real x473 = x452*x456; + + Real x474 = x452*x457; + + Real x475 = x452*x458; + + Real x476 = x452*x459; + + Real x477 = x452*x460; + + Real x478 = x452*x461; + + Real x479 = x452*x462; + + Real x480 = x450*x464; + + Real x481 = x450*x465; + + Real x482 = x450*x466; + + Real x483 = x450*x467; + + Real x484 = x450*x468; + + Real x485 = x450*x469; + + Real x486 = x450*x470; + + Real x487 = x456*x464; + + Real x488 = x457*x464; + + Real x489 = x458*x464; + + Real x490 = x459*x464; + + Real x491 = x460*x464; + + Real x492 = x461*x464; + + Real x493 = x456*x465; + + Real x494 = x457*x465; + + Real x495 = x458*x465; + + Real x496 = x459*x465; + + Real x497 = x460*x465; + + Real x498 = x456*x466; + + Real x499 = x457*x466; + + Real x500 = x458*x466; + + Real x501 = x459*x466; + + Real x502 = x456*x467; + + Real x503 = x457*x467; + + Real x504 = x458*x467; + + Real x505 = x456*x468; + + Real x506 = x457*x468; + + Real x507 = x456*x469; + + Real x508 = ((x455)*(x455)); + + Real x509 = ((x455)*(x455)*(x455)); + + Real x510 = ((((x455)*(x455)))*(((x455)*(x455)))); + + Real x511 = ((x455)*(x455)*(x455)*(x455)*(x455)); + + Real x512 = std::exp((6)*std::log(std::abs(x455))); + + Real x513 = ((x455)*(x455)*(x455)*(x455)*(x455)*(x455)*(x455)); + + Real x514 = std::exp((8)*std::log(std::abs(x455))); + + Real x515 = x450*x455; + + Real x516 = x450*x509; + + Real x517 = x450*x511; + + Real x518 = x455*x456; + + Real x519 = x455*x458; + + Real x520 = x455*x460; + + Real x521 = x452*x508; + + Real x522 = x452*x509; + + Real x523 = x452*x510; + + Real x524 = x452*x512; + + Real x525 = x452*x513; + + Real x526 = x455*x464; + + Real x527 = x455*x467; + + Real x528 = x455*x469; + + Real x529 = x456*x508; + + Real x530 = x456*x509; + + Real x531 = x456*x511; + + Real x532 = x457*x508; + + Real x533 = x457*x509; + + Real x534 = x459*x508; + + Real x535 = x464*x510; + + Real x536 = x465*x508; + + Real x537 = x465*x511; + + Real x538 = x466*x508; + + Real x539 = x466*x510; + + Real x540 = x467*x508; + + Real x541 = std::min(18.99981, x32*(x454 + std::log(std::max(9.9999999999999993e-41, X(27))))); + + Real x542 = ((x541)*(x541)); + + Real x543 = ((x541)*(x541)*(x541)); + + Real x544 = ((((x541)*(x541)))*(((x541)*(x541)))); + + Real x545 = ((x541)*(x541)*(x541)*(x541)*(x541)); + + Real x546 = std::exp((6)*std::log(std::abs(x541))); + + Real x547 = ((x541)*(x541)*(x541)*(x541)*(x541)*(x541)*(x541)); + + Real x548 = std::exp((8)*std::log(std::abs(x541))); + + Real x549 = std::min(13.99986, x449); + + Real x550 = std::min(3.9999600000000002, x61); + + Real x551 = std::min(24.999750000000002, x32*(x454 + std::log(std::max(9.9999999999999993e-41, X(30))))); + + Real x552 = ((x549)*(x549)); + + Real x553 = ((x549)*(x549)*(x549)); + + Real x554 = ((((x549)*(x549)))*(((x549)*(x549)))); + + Real x555 = ((x549)*(x549)*(x549)*(x549)*(x549)); + + Real x556 = std::exp((6)*std::log(std::abs(x549))); + + Real x557 = ((x549)*(x549)*(x549)*(x549)*(x549)*(x549)*(x549)); + + Real x558 = std::exp((8)*std::log(std::abs(x549))); + + Real x559 = ((x549)*(x549)*(x549)*(x549)*(x549)*(x549)*(x549)*(x549)*(x549)); + + Real x560 = ((x550)*(x550)); + + Real x561 = ((x550)*(x550)*(x550)); + + Real x562 = ((((x550)*(x550)))*(((x550)*(x550)))); + + Real x563 = ((x550)*(x550)*(x550)*(x550)*(x550)); + + Real x564 = std::exp((6)*std::log(std::abs(x550))); + + Real x565 = ((x550)*(x550)*(x550)*(x550)*(x550)*(x550)*(x550)); + + Real x566 = std::exp((8)*std::log(std::abs(x550))); + + Real x567 = ((x550)*(x550)*(x550)*(x550)*(x550)*(x550)*(x550)*(x550)*(x550)); + + Real x568 = x555*x560; + + Real x569 = ((x551)*(x551)); + + Real x570 = ((x551)*(x551)*(x551)); + + Real x571 = ((((x551)*(x551)))*(((x551)*(x551)))); + + Real x572 = ((x551)*(x551)*(x551)*(x551)*(x551)); + + Real x573 = std::exp((6)*std::log(std::abs(x551))); + + Real x574 = ((x551)*(x551)*(x551)*(x551)*(x551)*(x551)*(x551)); + + Real x575 = std::exp((8)*std::log(std::abs(x551))); + + Real x576 = ((x551)*(x551)*(x551)*(x551)*(x551)*(x551)*(x551)*(x551)*(x551)); + + Real x577 = x551*x552; + + Real x578 = x551*x553; + + Real x579 = x552*x569; + + Real x580 = x560*x573; + + Real x581 = x563*x571; + + Real x582 = x550*x551; + + Real x583 = x549*x570; + + Real x584 = x549*x573; + + Real x585 = x549*x574; + + Real x586 = x550*x556; + + Real x587 = x549*x551; + + Real x588 = x552*x570; + + Real x589 = x553*x569; + + Real x590 = x553*x570; + + Real x591 = x555*x570; + + Real x592 = x549*x569; + + Real x593 = x561*x570; + + Real x594 = x551*x561; + + Real x595 = x554*x560; + + Real x596 = x552*x561; + + Real x597 = x561*x569; + + + return (x1*(-7.1777505408000004e-12*((X(10))*(X(10)))*(std::pow(1.1800000000000001e-10*std::exp(-69500.0*x6), x34)*std::pow(8.1250000000000003e-8*std::pow(T, -0.5)*(1.0 - std::exp(-6000.0*x6))*std::exp(-52000.0*x6), 1.0 - x34) + 1.0e-99) + 7.1777505408000004e-12*X(10)*((X(4))*(X(4)))*x28*(2.5000000000000002e-32*x23 + 7.5000000000000001e-33*x29 + 1.0e-99) - 1.3854129535261706e-25*X(13)*x20 - 9.3799999999999993e-22*X(15)*x16*x18*std::exp(-285335.40000000002*x12) - 2.1299999999999999e-27*X(2)*x5*(4.0*X(13) + x2) - X(2)*x7*(4.3799999999999999e-10*std::pow(x4, 0.34999999999999998)*std::exp(-102000.0*x6) + 1.0e-99) - 5.6500000000000001e-36*X(2)*(-x3 + x4)*((((z + 1.0)*(z + 1.0)))*(((z + 1.0)*(z + 1.0)))) - 3.4635323838154264e-26*X(3)*x20 + 7.1777505408000004e-12*((X(4))*(X(4))*(X(4)))*x28*(2.0000000000000002e-31*x23 + 6.0000000000000001e-32*x29 + 1.0e-99) + 5.6556829037999995e-12*X(4)*X(5)*x28*((1.3500000000000001e-9*std::pow(x4, 0.098492999999999997) + 4.4350199999999998e-10*std::pow(x4, 0.55610000000000004) + 3.7408500000000004e-16*std::pow(x4, 2.1825999999999999))/(0.0061910000000000003*std::pow(x4, 1.0461) + 8.9711999999999997e-11*std::pow(x4, 3.0424000000000002) + 3.2575999999999999e-14*std::pow(x4, 3.7740999999999998) + 1.0) + 1.0e-99) + 1.75918975308e-21*X(4)*X(8)*x28 + 4.8065293799999994e-30*X(4)*user_dust2gas_ratio*x25*std::sqrt(x4)*(4.2000000000000002*x28 + 0.20000000000000001)/((1.0 + 10000.0*std::exp(-600.0/(Tdust + 9.9999999999999993e-41)))*(7.9999999999999996e-6*x27 + 0.002*x4 + 0.040000000000000001*std::sqrt(Tdust + x4) + 1.0)) - X(4)*x7*(std::pow(10.0, 42.707410000000003*x32*x50 + 21.360939999999999*x32*x56 - x53 - 2.0273650000000001*x55 - 21467.790000000001*x6 - 1657.4099999999999*x6/(std::pow(std::pow(10.0, -x57 - 8.1313220000000008)*x25, x60) + 1.0) - 142.7664 - (21.360939999999999*x32*x56 + 11.28215*x32*std::log(14254.549999999999*x6 + 1.0) - x53 - 4.7035149999999994*x55 + 70.138370000000009*x61 - 203.11568)/(std::pow(std::pow(10.0, -x57 - 9.3055640000000004)*x25, x60) + 1.0)) + std::pow(10.0, 69.700860000000006*x32*x63 + 43.20243*x33*x54 - 23705.700000000001*x6 - 2080.4099999999999*x6/(std::pow(std::pow(10.0, -x64 - 13.656822)*x25, x65) + 1.0) - 68.422430000000006*x61 - x62 - 178.4239 - (69.700860000000006*x32*x63 + 19.734269999999999*x32*std::log(16780.950000000001*x6 + 1.0) + 37.886913*x55 - 14.509090000000008*x61 - x62 - 307.31920000000002)/(std::pow(std::pow(10.0, -x64 - 14.82123)*x25, x65) + 1.0)) + 3.0000000000000001e-99) - 0.00022681492*x0*((((x4)*(x4)))*(((x4)*(x4))))*x69*((((x66 && x68 && x72 && x73 && x9) ? ( + 4.8339620236294848e-32/((x77 + 2.1986273043946046e-56)*(x77 + 2.1986273043946046e-56)) >= 1.0 +) +: ( + ((x68 && x72 && x73 && x9) ? ( + 4.8339620236294848e-32/((x79 + 2.1986273043946046e-56)*(x79 + 2.1986273043946046e-56)) >= 1.0 + ) + : ( + ((x72 && x73 && x9) ? ( + true + ) + : ( + ((x66 && x68 && x72 && x73) ? ( + 1.7706820599375401e-32/((x81 + 1.3306697786970064e-56)*(x81 + 1.3306697786970064e-56)) >= 1.0 + ) + : ( + ((x68 && x72 && x73) ? ( + 1.7706820599375401e-32/((x82 + 1.3306697786970064e-56)*(x82 + 1.3306697786970064e-56)) >= 1.0 + ) + : ( + ((x72 && x73) ? ( + true + ) + : ( + ((x66 && x68 && x72 && x9) ? ( + 26194.42746515579/((x77*x84 + 1.6184692602936822e-38)*(x77*x84 + 1.6184692602936822e-38)) >= 1.0 + ) + : ( + ((x68 && x72 && x9) ? ( + 26194.42746515579/((x79*x84 + 1.6184692602936822e-38)*(x79*x84 + 1.6184692602936822e-38)) >= 1.0 + ) + : ( + ((x72 && x9) ? ( + true + ) + : ( + ((x66 && x68 && x72) ? ( + 9595.028375514943/((x81*x84 + 9.7954215710784709e-39)*(x81*x84 + 9.7954215710784709e-39)) >= 1.0 + ) + : ( + ((x68 && x72) ? ( + 9595.028375514943/((x82*x84 + 9.7954215710784709e-39)*(x82*x84 + 9.7954215710784709e-39)) >= 1.0 + ) + : ( + ((x72) ? ( + true + ) + : ( + ((x66 && x68 && x73 && x9) ? ( + 4.833962023629485e-72/((x77*x85 + 2.1986273043946045e-76)*(x77*x85 + 2.1986273043946045e-76)) >= 1.0 + ) + : ( + ((x68 && x73 && x9) ? ( + 4.833962023629485e-72/((x79*x85 + 2.1986273043946045e-76)*(x79*x85 + 2.1986273043946045e-76)) >= 1.0 + ) + : ( + ((x73 && x9) ? ( + true + ) + : ( + ((x66 && x68 && x73) ? ( + 1.7706820599375401e-72/((x81*x85 + 1.3306697786970064e-76)*(x81*x85 + 1.3306697786970064e-76)) >= 1.0 + ) + : ( + ((x68 && x73) ? ( + 1.7706820599375401e-72/((x82*x85 + 1.3306697786970064e-76)*(x82*x85 + 1.3306697786970064e-76)) >= 1.0 + ) + : ( + ((x73) ? ( + true + ) + : ( + ((x66 && x68 && x9) ? ( + 2.6194427465155784e-36/((x77*x87 + 1.618469260293682e-58)*(x77*x87 + 1.618469260293682e-58)) >= 1.0 + ) + : ( + ((x68 && x9) ? ( + 2.6194427465155784e-36/((x79*x87 + 1.618469260293682e-58)*(x79*x87 + 1.618469260293682e-58)) >= 1.0 + ) + : ( + ((x9) ? ( + true + ) + : ( + ((x66 && x68) ? ( + 9.5950283755149395e-37/((x81*x87 + 9.7954215710784688e-59)*(x81*x87 + 9.7954215710784688e-59)) >= 1.0 + ) + : ( + ((x68) ? ( + 9.5950283755149395e-37/((x82*x87 + 9.7954215710784688e-59)*(x82*x87 + 9.7954215710784688e-59)) >= 1.0 + ) + : ( + true + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) +))) ? ( + 1.0 +) +: ( + 483396202.36294854/((x69*x75*std::sqrt(((x72) ? ( + 9.9999999999999993e-41 + ) + : ( + x71 + ))*((x73) ? ( + 1.0e+80 + ) + : ( + 1.8454161787119389e+44*x86 + )))*((x9) ? ( + x13 + ) + : ( + x15 + )) + 2.1986273043946046e-36)*(x69*x75*std::sqrt(((x72) ? ( + 9.9999999999999993e-41 + ) + : ( + x71 + ))*((x73) ? ( + 1.0e+80 + ) + : ( + 1.8454161787119389e+44*x86 + )))*((x9) ? ( + x13 + ) + : ( + x15 + )) + 2.1986273043946046e-36)) +)) - 1.24e-13*x11*(1.0 + 0.29999999999999999*std::exp(-94000.0*x12))*((x8) ? ( + 0.031622776601683791 +) +: ((x9) ? ( + std::pow(T, -1.5) +) +: ( + 0.22169506691164925*std::pow(x10, -1.5) +)))*std::exp(-470000.0*x12) - 1.5499999999999999e-26*x11*((x8) ? ( + 2.3157944032250755 +) +: ((x9) ? ( + std::pow(T, 0.36470000000000002) +) +: ( + 1.4423428878129001*std::pow(x10, 0.36470000000000002) +))) - 1.2700000000000001e-21*x16*x19*std::exp(-157809.10000000001*x12) - 4.9500000000000001e-22*x16*x21*std::exp(-631515.0*x12) - 7.4999999999999996e-19*x19*std::exp(-118348.0*x12) - 5.5399999999999998e-17*x21*((x8) ? ( + 0.4008667176273028 +) +: ((x9) ? ( + std::pow(T, -0.39700000000000002) +) +: ( + 0.67118683452634376*std::pow(x10, -0.39700000000000002) +)))*std::exp(-473638.0*x12) - 5.0099999999999997e-27*x22*std::exp(-55338.0*x12) - 9.1000000000000001e-27*x22*std::exp(-13179.0*x12) - ((x4 < 2.0) ? ( + 0 +) +: ( + X(10)*((((x101 && x111 && x119 && x128 && x129 && x89) ? ( + x134 && x139 + ) + : ( + ((x101 && x111 && x121 && x128 && x129 && x89) ? ( + x134 && x142 + ) + : ( + ((x101 && x111 && x123 && x128 && x129 && x89) ? ( + x134 && x144 + ) + : ( + ((x101 && x111 && x128 && x129 && x89) ? ( + x134 && x146 + ) + : ( + ((x119 && x128 && x129 && x89) ? ( + x134 && x149 + ) + : ( + ((x121 && x128 && x129 && x89) ? ( + x134 && x152 + ) + : ( + ((x123 && x128 && x129 && x89) ? ( + x134 && x154 + ) + : ( + ((x128 && x129 && x89) ? ( + x134 && x156 + ) + : ( + ((x101 && x111 && x119 && x132 && x89) ? ( + x134 && x158 + ) + : ( + ((x101 && x111 && x121 && x132 && x89) ? ( + x134 && x159 + ) + : ( + ((x101 && x111 && x123 && x132 && x89) ? ( + x134 && x160 + ) + : ( + ((x101 && x111 && x132 && x89) ? ( + x134 && x161 + ) + : ( + ((x119 && x132 && x89) ? ( + x134 && x162 + ) + : ( + ((x121 && x132 && x89) ? ( + x134 && x163 + ) + : ( + ((x123 && x132 && x89) ? ( + x134 && x164 + ) + : ( + ((x132 && x89) ? ( + x134 && x165 + ) + : ( + ((x101 && x111 && x119 && x89) ? ( + x134 && x166 + ) + : ( + ((x101 && x111 && x121 && x89) ? ( + x134 && x167 + ) + : ( + ((x101 && x111 && x123 && x89) ? ( + x134 && x168 + ) + : ( + ((x101 && x111 && x89) ? ( + x134 && x169 + ) + : ( + ((x119 && x89) ? ( + x134 && x170 + ) + : ( + ((x121 && x89) ? ( + x134 && x171 + ) + : ( + ((x123 && x89) ? ( + x134 && x172 + ) + : ( + ((x89) ? ( + x134 && x173 + ) + : ( + ((x101 && x111 && x119 && x128 && x129) ? ( + x139 && x174 + ) + : ( + ((x101 && x111 && x121 && x128 && x129) ? ( + x142 && x174 + ) + : ( + ((x101 && x111 && x123 && x128 && x129) ? ( + x144 && x174 + ) + : ( + ((x101 && x111 && x128 && x129) ? ( + x146 && x174 + ) + : ( + ((x101 && x119 && x128 && x129) ? ( + x149 && x174 + ) + : ( + ((x101 && x121 && x128 && x129) ? ( + x152 && x174 + ) + : ( + ((x101 && x123 && x128 && x129) ? ( + x154 && x174 + ) + : ( + ((x101 && x128 && x129) ? ( + x156 && x174 + ) + : ( + ((x101 && x111 && x119 && x132) ? ( + x158 && x174 + ) + : ( + ((x101 && x111 && x121 && x132) ? ( + x159 && x174 + ) + : ( + ((x101 && x111 && x123 && x132) ? ( + x160 && x174 + ) + : ( + ((x101 && x111 && x132) ? ( + x161 && x174 + ) + : ( + ((x101 && x119 && x132) ? ( + x162 && x174 + ) + : ( + ((x101 && x121 && x132) ? ( + x163 && x174 + ) + : ( + ((x101 && x123 && x132) ? ( + x164 && x174 + ) + : ( + ((x101 && x132) ? ( + x165 && x174 + ) + : ( + ((x101 && x111 && x119) ? ( + x166 && x174 + ) + : ( + ((x101 && x111 && x121) ? ( + x167 && x174 + ) + : ( + ((x101 && x111 && x123) ? ( + x168 && x174 + ) + : ( + ((x112) ? ( + x169 && x174 + ) + : ( + ((x101 && x119) ? ( + x170 && x174 + ) + : ( + ((x101 && x121) ? ( + x171 && x174 + ) + : ( + ((x101 && x123) ? ( + x172 && x174 + ) + : ( + ((x101) ? ( + x173 && x174 + ) + : ( + ((x119 && x128 && x129) ? ( + x149 && x175 + ) + : ( + ((x121 && x128 && x129) ? ( + x152 && x175 + ) + : ( + ((x123 && x128 && x129) ? ( + x154 && x175 + ) + : ( + ((x130) ? ( + x156 && x175 + ) + : ( + ((x119 && x132) ? ( + x162 && x175 + ) + : ( + ((x121 && x132) ? ( + x163 && x175 + ) + : ( + ((x123 && x132) ? ( + x164 && x175 + ) + : ( + ((x132) ? ( + x165 && x175 + ) + : ( + ((x119) ? ( + x170 && x175 + ) + : ( + ((x121) ? ( + x171 && x175 + ) + : ( + ((x123) ? ( + x172 && x175 + ) + : ( + x173 && x175 + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + )) + ))) ? ( + x103*x133/(x103 + x133) + ) + : ( + 0 + ))*std::min(1.0, std::pow(std::max(9.9999999999999993e-41, 1.2500000000000001e-10*X(0) + 1.2500000000000001e-10*X(1) + 1.2500000000000001e-10*X(10) + 1.2500000000000001e-10*X(11) + 1.2500000000000001e-10*X(12) + 1.2500000000000001e-10*X(13) + 1.2500000000000001e-10*X(14) + 1.2500000000000001e-10*X(15) + 1.2500000000000001e-10*X(16) + 1.2500000000000001e-10*X(17) + 1.2500000000000001e-10*X(18) + 1.2500000000000001e-10*X(19) + 1.2500000000000001e-10*X(2) + 1.2500000000000001e-10*X(20) + 1.2500000000000001e-10*X(21) + 1.2500000000000001e-10*X(22) + 1.2500000000000001e-10*X(23) + 1.2500000000000001e-10*X(24) + 1.2500000000000001e-10*X(25) + 1.2500000000000001e-10*X(26) + 1.2500000000000001e-10*X(27) + 1.2500000000000001e-10*X(28) + 1.2500000000000001e-10*X(29) + 1.2500000000000001e-10*X(3) + 1.2500000000000001e-10*X(30) + 1.2500000000000001e-10*X(31) + 1.2500000000000001e-10*X(32) + 1.2500000000000001e-10*X(33) + 1.2500000000000001e-10*X(4) + 1.2500000000000001e-10*X(5) + 1.2500000000000001e-10*X(6) + 1.2500000000000001e-10*X(7) + 1.2500000000000001e-10*X(8) + 1.2500000000000001e-10*X(9)), -0.45000000000000001)) +)) - ((x3 <= x4) ? ( + std::pow(10.0, 0.92432999999999998*x32*x36 + 21.93385*x32*x42 + 0.77951999999999999*x33*x36*x42 + 0.54962*x33*x41 - 10.19097*x33*x45 + 0.11711000000000001*x36*x37*x44 - 0.54262999999999995*x36*x39*x45 - 0.0083499999999999998*x36*x43*x46 + 0.0027499999999999998*x37*x38 + 0.11864*x37*x40*x42 + 0.62343000000000004*x37*x41*x45 - 0.17333999999999999*x37*x43 - 0.0036600000000000001*x38*x42*x46 + 6.1920000000000003e-5*x38*x43*x47 - 0.00066631000000000004*x38*x44*x48 + 0.0025140000000000002*x38*x45*x49 - 0.076759999999999995*x39*x40 - 1.06447*x39*x41*x42 + 2.1990599999999998*x39*x44 - 0.001482*x40*x43*x48 + 0.017590000000000001*x40*x44*x49 - 0.073660000000000003*x40*x45*x46 + 0.0106*x41*x43*x49 - 0.13768*x41*x44*x46 - 42.567880000000002)*X(12) +) +: ( + 0 +)) - ((x368) ? ( + 16.0*x176*(std::pow(10, ((x178) ? ( + 21.754701117084799*x177 - 116.63708847273 + ) + : ((x179) ? ( + 21.654524283752401*x177 - 116.23425846251899 + ) + : ((x180) ? ( + 18.5204063550573*x177 - 103.56805719106799 + ) + : ((x181) ? ( + 18.464966359964599*x177 - 103.34272366009 + ) + : ((x182) ? ( + 18.4738710236347*x177 - 103.379111320018 + ) + : ((x183) ? ( + 18.496102204755299*x177 - 103.47041944875301 + ) + : ((x184) ? ( + 16.054373436314101*x177 - 93.393148932214004 + ) + : ((x185) ? ( + 16.272829224597899*x177 - 94.2995698642317 + ) + : ((x186) ? ( + 16.129118889353101*x177 - 93.700260155053897 + ) + : ((x187) ? ( + 14.122013026334299*x177 - 85.289820835661899 + ) + : ((x188) ? ( + 14.409888024284299*x177 - 86.502404333645202 + ) + : ((x189) ? ( + 12.72751073123*x177 - 79.380907795934903 + ) + : ((x190) ? ( + 12.854828907526301*x177 - 79.922681330927801 + ) + : ((x191) ? ( + 11.5954693312581*x177 - 74.537078205297803 + ) + : ((x192) ? ( + 11.6072033454627*x177 - 74.587521008359502 + ) + : ((x193) ? ( + 10.4043963894105*x177 - 69.391219004261998 + ) + : ((x194) ? ( + 10.0401485348532*x177 - 67.809500859189896 + ) + : ((x195) ? ( + 8.8791085408720392*x177 - 62.743172832321797 + ) + : ((x196) ? ( + 7.3959289430042601*x177 - 56.238531083038701 + ) + : ((x197) ? ( + 6.3207533825905102*x177 - 51.498899207896102 + ) + : ((x198) ? ( + 4.3981723244085096*x177 - 42.982341381924897 + ) + : ((x199) ? ( + 2.6062918523723502*x177 - 35.005272202434803 + ) + : ((x200) ? ( + 1.0829193289553101*x177 - 28.189374081916 + ) + : ((x201) ? ( + -23.3195620450633 + ) + : ((x202) ? ( + -0.68343477309326806*x177 - 20.2314524958447 + ) + : ((x203) ? ( + -1.0448841649842999*x177 - 18.590353168197002 + ) + : ((x204) ? ( + -0.93857251371400696*x177 - 19.0753780561963 + ) + : ((x205) ? ( + -0.48633999740536599*x177 - 21.148561701384999 + ) + : ((x206) ? ( + 0.38886362957714499*x177 - 25.180083379393199 + ) + : ((x207) ? ( + 1.74487735737534*x177 - 31.457626347376401 + ) + : ((x208) ? ( + 3.3281355809456299*x177 - 38.821800513152098 + ) + : ((x209) ? ( + 4.6061329573167296*x177 - 44.793908972190401 + ) + : ((x210) ? ( + 5.6429036178622001*x177 - 49.662046611502802 + ) + : ((x211) ? ( + 6.4322416927964197*x177 - 53.385883564516902 + ) + : ((x212) ? ( + 6.5177996180557303*x177 - 53.791391540924501 + ) + : ((x213) ? ( + 6.31944631516944*x177 - 52.846847426068997 + ) + : ((x214) ? ( + 5.7618800359940696*x177 - 50.1795041074392 + ) + : ((x215) ? ( + 4.9558188961754004*x177 - 46.3054291994358 + ) + : ((x216) ? ( + 4.0940010586316502*x177 - 42.144003969169702 + ) + : ((x217) ? ( + 2.9053814770816202*x177 - 36.378430870859098 + ) + : ((x218) ? ( + 1.6364882433366601*x177 - 30.1954455428722 + ) + : ((x219) ? ( + 0.57957990015472705*x177 - 25.021432610563402 + ) + : ((x220) ? ( + -0.37722629739323599*x177 - 20.316332862546901 + ) + : ((x221) ? ( + -1.0785413526091401*x177 - 16.852173645155698 + ) + : ((x222) ? ( + -1.60938500361908*x177 - 14.218182935985199 + ) + : ((x223) ? ( + -1.78758716733068*x177 - 13.3300096244384 + ) + : ((x224) ? ( + -2.2700140615443201*x177 - 10.913726199217299 + ) + : ((x225) ? ( + -2.5341768927707999*x177 - 9.5851499411792194 + ) + : ((x226) ? ( + -2.2864086101139902*x177 - 10.8361860194154 + ) + : ((x227) ? ( + -2.36319341360604*x177 - 10.4467425561506 + ) + : ((x228) ? ( + -2.2038598336806698*x177 - 11.258295667315901 + ) + : ((x229) ? ( + -2.1995190626624899*x177 - 11.280508570249401 + ) + : ((x230) ? ( + -2.3142598583085601*x177 - 10.6907547543515 + ) + : ((x231) ? ( + -2.0228191377754001*x177 - 12.194987563858399 + ) + : ((x232) ? ( + -2.2107322889946799*x177 - 11.220715858995399 + ) + : ((x233) ? ( + -2.1936659362015698*x177 - 11.309577386327 + ) + : ((x234) ? ( + -1.96521634754163*x177 - 12.5038859535562 + ) + : ((x235) ? ( + -1.73340869575622*x177 - 13.720973485178501 + ) + : ((x236) ? ( + -1.88707409957794*x177 - 12.9105178894524 + ) + : ((x237) ? ( + -1.89274422539165*x177 - 12.880485131430801 + ) + : ((x238) ? ( + -1.83489006530021*x177 - 13.188157218986801 + ) + : ((x239) ? ( + -1.76014293823027*x177 - 13.5873400738501 + ) + : ((x240) ? ( + -1.6626036087568501*x177 - 14.1103194117941 + ) + : ((x241) ? ( + -1.58129253681238*x177 - 14.5480832103522 + ) + : ((x242) ? ( + -1.4926049531937899*x177 - 15.027576194692299 + ) + : ((x243) ? ( + -1.5114512632196699*x177 - 14.925245399858801 + ) + : ((x244) ? ( + -1.4516059476316101*x177 - 15.2515092796129 + ) + : ((x245) ? ( + -1.44395612367339*x177 - 15.293386070343301 + ) + : ((x246) ? ( + -1.3258910340154*x177 - 15.942218005274301 + ) + : ((x247) ? ( + -1.3032756985248899*x177 - 16.0670210494327 + ) + : ((x248) ? ( + -1.2147875556861401*x177 - 16.5572745153722 + ) + : ((x249) ? ( + -1.2196320624352699*x177 - 16.530322193704698 + ) + : ((x250) ? ( + -1.1416925189096201*x177 - 16.9656504533441 + ) + : ((x251) ? ( + -1.13067926484268*x177 - 17.027406780183799 + ) + : ((x252) ? ( + -1.0682101260908901*x177 - 17.3790711495203 + ) + : ((x253) ? ( + -1.0501935059121501*x177 - 17.480905525003401 + ) + : ((x254) ? ( + -0.41275239741184999*x177 - 21.0977094021782 + ) + : ((x255) ? ( + -0.91231033068379497*x177 - 18.252049377442699 + ) + : ((x256) ? ( + -0.93551361062486604*x177 - 18.119361381912299 + ) + : ((x257) ? ( + -0.94606988055807095*x177 - 18.058756235906898 + ) + : ((x258) ? ( + -0.896384524888163*x177 - 18.345114205644698 + ) + : ((x259) ? ( + -0.84122149387258105*x177 - 18.664250534770002 + ) + : ((x260) ? ( + -0.80056567602309803*x177 - 18.900388102116299 + ) + : ((x261) ? ( + -0.80446638937769399*x177 - 18.8776471511819 + ) + : ((x262) ? ( + -0.72505392685775405*x177 - 19.342406999326201 + ) + : ((x263) ? ( + -0.66514126907691196*x177 - 19.694362818109798 + ) + : ((x264) ? ( + -0.63567972071018597*x177 - 19.868099837462101 + ) + : ((x265) ? ( + -0.57153470317143695*x177 - 20.2477792055106 + ) + : ((x266) ? ( + -0.593071610313473*x177 - 20.119817425502301 + ) + : ((x267) ? ( + -0.52801073197974802*x177 - 20.507826699745198 + ) + : ((x268) ? ( + -0.46979925674099798*x177 - 20.8562994380645 + ) + : ((x269) ? ( + -0.51597713271462498*x177 - 20.578835044557302 + ) + : ((x270) ? ( + -0.38588345232369597*x177 - 21.3632197706856 + ) + : ((x271) ? ( + -0.33183685767562598*x177 - 21.6903680476935 + ) + : ((x272) ? ( + -0.35510482470181198*x177 - 21.549002421331402 + ) + : ((x273) ? ( + -0.32627708059271798*x177 - 21.7247625830414 + ) + : ((x274) ? ( + -0.262119181450089*x177 - 22.117445748014699 + ) + : ((x275) ? ( + -0.27945128201577102*x177 - 22.010974397719998 + ) + : ((x276) ? ( + -0.17357119112580199*x177 - 22.663656638367701 + ) + : ((x277) ? ( + -0.18454134199941999*x177 - 22.5957786025274 + ) + : ((x278) ? ( + -0.195718275294439*x177 - 22.526375267415499 + ) + : ((x279) ? ( + -0.092088487356022597*x177 - 23.172035367899301 + ) + : ((x280) ? ( + -0.17603455025471201*x177 - 22.6471329740634 + ) + : ((x281) ? ( + -0.093473451786849196*x177 - 23.165324555106999 + ) + : ((x282) ? ( + -0.098769754173417795*x177 - 23.131963924526602 + ) + : ((x283) ? ( + -23.756203219546499 + ) + : ((x284) ? ( + -0.0916250359027799*x177 - 23.1750785137056 + ) + : ((x285) ? ( + -23.7583165788601 + ) + : ((x286) ? ( + -23.758316578859201 + ) + : (((x287 || x288) && (x287 || x289) && (x288 || x290) && (x289 || x290)) ? ( + -23.7583165788601 + ) + : ((x291) ? ( + 0.094545414847061707*x177 - 24.368448238459699 + ) + : ((x292) ? ( + -23.756203219546499 + ) + : ((x293) ? ( + 0.0921310845128573*x177 - 24.354899618367199 + ) + : ((x294) ? ( + 0.19255196936796901*x177 - 25.0097580749953 + ) + : ((x295) ? ( + 0.17965853582722999*x177 - 24.925398590184201 + ) + : ((x296) ? ( + 0.18739974916320501*x177 - 24.9762262188815 + ) + : ((x297) ? ( + 0.0929547420082599*x177 - 24.354049809656299 + ) + : ((x298) ? ( + 0.26444436207134497*x177 - 25.4875266436648 + ) + : ((x299) ? ( + 0.18344929257977999*x177 - 24.950330304384799 + ) + : ((x300) ? ( + 0.17534071884347199*x177 - 24.896374423240601 + ) + : ((x301) ? ( + 0.26286770031606499*x177 - 25.480765261107098 + ) + : ((x302) ? ( + -23.719822421582599 + ) + : ((x303) ? ( + 0.18996659121990001*x177 - 24.992567756089599 + ) + : ((x304) ? ( + 0.28346947226873498*x177 - 25.620922012067201 + ) + : ((x305) ? ( + 0.19562119620559301*x177 - 25.028792769753601 + ) + : ((x306) ? ( + 0.27138121268399101*x177 - 25.540905317055099 + ) + : ((x307) ? ( + 0.187506936264072*x177 - 24.972211108603901 + ) + : ((x308) ? ( + 0.271954725207252*x177 - 25.546458552738802 + ) + : ((x309) ? ( + 0.27217103152884198*x177 - 25.5479338054311 + ) + : ((x310) ? ( + 0.27254430592620299*x177 - 25.550487041911801 + ) + : ((x311) ? ( + 0.257793610827321*x177 - 25.4493011298628 + ) + : ((x312) ? ( + 0.26672013863549199*x177 - 25.510717799401402 + ) + : ((x313) ? ( + 0.25415159849489999*x177 - 25.4239971284542 + ) + : ((x314) ? ( + 0.34109312725649898*x177 - 26.025643229659199 + ) + : ((x315) ? ( + 0.251333081394705*x177 - 25.402706881785001 + ) + : ((x316) ? ( + 0.24806513642010899*x177 - 25.379962001630702 + ) + : ((x317) ? ( + 0.326598415643502*x177 - 25.928124555390198 + ) + : ((x318) ? ( + 0.30364902511269098*x177 - 25.7674788216755 + ) + : ((x319) ? ( + 0.39156134499853601*x177 - 26.384727861312101 + ) + : ((x320) ? ( + 0.40244894051784302*x177 - 26.461391696761002 + ) + : ((x321) ? ( + 0.41295357257149601*x177 - 26.535561729617299 + ) + : ((x322) ? ( + 0.35399730258495798*x177 - 26.1181996087935 + ) + : ((x323) ? ( + 0.36496841849043399*x177 - 26.196098597014501 + ) + : ((x324) ? ( + 0.449940914598983*x177 - 26.801151537676599 + ) + : ((x325) ? ( + 0.33077927491262898*x177 - 25.950351838576399 + ) + : ((x326) ? ( + 0.47583381883919201*x177 - 26.989140808031198 + ) + : ((x327) ? ( + 0.34862735234924003*x177 - 26.075928517551802 + ) + : ((x328) ? ( + 0.37726341485836201*x177 - 26.282069711876801 + ) + : ((x329) ? ( + 0.38865860364944599*x177 - 26.364344206633199 + ) + : ((x330) ? ( + 0.39964405616001403*x177 - 26.4438849165508 + ) + : ((x331) ? ( + 0.36562478549376498*x177 - 26.1969025829458 + ) + : ((x332) ? ( + 0.37662883760390298*x177 - 26.277023453532799 + ) + : ((x333) ? ( + 0.38725746066734201*x177 - 26.354623349332499 + ) + : ((x334) ? ( + 0.35860233859102703*x177 - 26.144863663888799 + ) + : ((x335) ? ( + 0.36917779762143299*x177 - 26.222492229888299 + ) + : ((x336) ? ( + 0.40271077993679699*x177 - 26.4692894629625 + ) + : ((x337) ? ( + 0.35514459093678902*x177 - 26.118240940179 + ) + : ((x338) ? ( + 0.33545503376080898*x177 - 25.972544641355899 + ) + : ((x339) ? ( + 0.40281094705665099*x177 - 26.4723225374109 + ) + : ((x340) ? ( + 0.32803653589985499*x177 - 25.916050815831099 + ) + : ((x341) ? ( + 0.314445735562003*x177 - 25.814671701888098 + ) + : ((x342) ? ( + 0.37815752055462298*x177 - 26.291236295979601 + ) + : ((x343) ? ( + 0.414682051846057*x177 - 26.565158851504702 + ) + : ((x344) ? ( + 0.39970178784710703*x177 - 26.4525098429312 + ) + : ((x345) ? ( + 0.35988322371804299*x177 - 26.152264750186099 + ) + : ((x346) ? ( + 0.39817279188127902*x177 - 26.441730310214599 + ) + : ((x347) ? ( + 0.38671733854766899*x177 - 26.354900452943198 + ) + : ((x348) ? ( + 0.37703797494805302*x177 - 26.281338421375001 + ) + : ((x349) ? ( + 0.32308221855055302*x177 - 25.870188216675199 + ) + : ((x350) ? ( + 0.38037124230777403*x177 - 26.307903939235999 + ) + : ((x351) ? ( + 0.31179964733701099*x177 - 25.782651268054899 + ) + : ((x352) ? ( + 0.32174532218346003*x177 - 25.8590373877832 + ) + : ((x353) ? ( + 0.304374840933406*x177 - 25.725287500936201 + ) + : ((x354) ? ( + 0.30185624255250298*x177 - 25.705843520214302 + ) + : ((x355) ? ( + 0.26728586673743798*x177 - 25.438256273093401 + ) + : ((x356) ? ( + 0.24695100363146599*x177 - 25.280464489724199 + ) + : ((x357) ? ( + 0.25569260325596599*x177 - 25.348476908618998 + ) + : ((x358) ? ( + 0.24699463413776401*x177 - 25.280632494132099 + ) + : ((x359) ? ( + 0.20642312374434399*x177 - 24.9633551093393 + ) + : ((x360) ? ( + 0.207323288943144*x177 - 24.970412500000698 + ) + : ((x361) ? ( + 0.19667532416269801*x177 - 24.886722280563799 + ) + : ((x362) ? ( + 0.163403741551292*x177 - 24.624534165317499 + ) + : ((x363) ? ( + 0.15642366770180199*x177 - 24.569392834813701 + ) + : ((x364) ? ( + 0.15847268149263999*x177 - 24.5856212767339 + ) + : ((x365) ? ( + 0.117620139421206*x177 - 24.2612513510085 + ) + : ((x366) ? ( + 0.15559538445018001*x177 - 24.563534105424001 + ) + : ((x367) ? ( + 0.077427480804772103*x177 - 23.939753970784299 + ) + : ( + -9.9999999999999997e+98 + ))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))) + std::pow(10, ((x178) ? ( + 2.93326303855088*x177 - 34.858441143158402 + ) + : ((x179) ? ( + 2.9412722431245601*x177 - 34.890647670884398 + ) + : ((x180) ? ( + 2.56669738238736*x177 - 33.376843568657499 + ) + : ((x181) ? ( + 2.52371857917433*x177 - 33.202158028569102 + ) + : ((x182) ? ( + 2.5917911951007699*x177 - 33.480327231859498 + ) + : ((x183) ? ( + 2.72370456532667*x177 - 34.022123141182398 + ) + : ((x184) ? ( + 2.4670363083973799*x177 - 32.962826346421899 + ) + : ((x185) ? ( + 2.5584967274005499*x177 - 33.3423156650015 + ) + : ((x186) ? ( + 2.5461946466152798*x177 - 33.291012768482702 + ) + : ((x187) ? ( + 2.0488420441586199*x177 - 31.206940393240998 + ) + : ((x188) ? ( + 1.63567014261275*x177 - 29.466582831060801 + ) + : ((x189) ? ( + 1.1806405542702101*x177 - 27.540444353494401 + ) + : ((x190) ? ( + 0.86289765826336395*x177 - 26.188361744423698 + ) + : ((x191) ? ( + 0.56265183697246401*x177 - 24.9043719578112 + ) + : ((x192) ? ( + 0.55364747214684895*x177 - 24.865663516378799 + ) + : ((x193) ? ( + 0.530067235381807*x177 - 24.763793444092698 + ) + : ((x194) ? ( + 0.70626361876998101*x177 - 25.528912615597601 + ) + : ((x195) ? ( + 0.91330605119549102*x177 - 26.432365454074901 + ) + : ((x196) ? ( + 1.1364977363308499*x177 - 27.411196308620699 + ) + : ((x197) ? ( + 1.4273279400174499*x177 - 28.693245635631701 + ) + : ((x198) ? ( + 1.60660732583608*x177 - 29.487408903718499 + ) + : ((x199) ? ( + 1.7241382767553*x177 - 30.010631596775099 + ) + : ((x200) ? ( + 1.8405988654025101*x177 - 30.5317014566244 + ) + : ((x201) ? ( + 2.00636090105013*x177 - 31.277121669252701 + ) + : ((x202) ? ( + 2.0766266686417798*x177 - 31.594618519612599 + ) + : ((x203) ? ( + 2.1055476263965098*x177 - 31.725929196544701 + ) + : ((x204) ? ( + 2.1206678994118402*x177 - 31.794912310231702 + ) + : ((x205) ? ( + 2.0681491225742499*x177 - 31.5541488417084 + ) + : ((x206) ? ( + 1.9431479613642799*x177 - 30.9783458220945 + ) + : ((x207) ? ( + 2.05657373686677*x177 - 31.5034401959911 + ) + : ((x208) ? ( + 1.9996974842122199*x177 - 31.238892932500701 + ) + : ((x209) ? ( + 1.9353186995018601*x177 - 30.938049525572801 + ) + : ((x210) ? ( + 1.8764948502316701*x177 - 30.661843219184401 + ) + : ((x211) ? ( + 1.8476148800607499*x177 - 30.525597035782098 + ) + : ((x212) ? ( + 1.74703872538521*x177 - 30.048909074570499 + ) + : ((x213) ? ( + 1.7321135872356299*x177 - 29.977836643723101 + ) + : ((x214) ? ( + 1.6021313147378999*x177 - 29.356013985079699 + ) + : ((x215) ? ( + 1.5381019612034399*x177 - 29.048277388374999 + ) + : ((x216) ? ( + 1.45157467866989*x177 - 28.630466569249599 + ) + : ((x217) ? ( + 1.2972328154280599*x177 - 27.8818087913833 + ) + : ((x218) ? ( + 1.15329138198717*x177 - 27.1804197797737 + ) + : ((x219) ? ( + 1.1215547707139399*x177 - 27.0250556574128 + ) + : ((x220) ? ( + 1.01840908159215*x177 - 26.517836162870498 + ) + : ((x221) ? ( + 0.92272259671210599*x177 - 26.045190928589399 + ) + : ((x222) ? ( + 0.83372798800292003*x177 - 25.603608982454698 + ) + : ((x223) ? ( + 0.54375987608625598*x177 - 24.158385575286999 + ) + : ((x224) ? ( + 0.26777430271999902*x177 - 22.776084185120499 + ) + : ((x225) ? ( + -0.051498455835144299*x177 - 21.170338952585599 + ) + : ((x226) ? ( + -0.27800168012061*x177 - 20.026674790331501 + ) + : ((x227) ? ( + -0.35713542850248797*x177 - 19.6253177557419 + ) + : ((x228) ? ( + -0.20055317060939601*x177 - 20.422857223607 + ) + : ((x229) ? ( + 0.0049179296178181202*x177 - 21.4743085868859 + ) + : ((x230) ? ( + 0.21946625207999701*x177 - 22.5770610225327 + ) + : ((x231) ? ( + 0.37033984879133203*x177 - 23.355775176980401 + ) + : ((x232) ? ( + 0.44156034872162297*x177 - 23.725031492667799 + ) + : ((x233) ? ( + 0.48350154352135599*x177 - 23.943411991022 + ) + : ((x234) ? ( + 0.38971187416564101*x177 - 23.453090225567401 + ) + : ((x235) ? ( + 0.33868894996362497*x177 - 23.1851984437608 + ) + : ((x236) ? ( + 0.322702410666238*x177 - 23.100882912042799 + ) + : ((x237) ? ( + 0.34002456808514098*x177 - 23.192632580264199 + ) + : ((x238) ? ( + 0.29125790095929499*x177 - 22.933288355853598 + ) + : ((x239) ? ( + 0.17829221455576799*x177 - 22.330001420721601 + ) + : ((x240) ? ( + -0.111369316280047*x177 - 20.7769151278153 + ) + : ((x241) ? ( + -0.58568062507549701*x177 - 18.223310615264399 + ) + : ((x242) ? ( + -1.2361127484671199*x177 - 14.706723205502399 + ) + : ((x243) ? ( + -2.1008525824407802*x177 - 10.011400120375599 + ) + : ((x244) ? ( + -2.7420796120589999*x177 - 6.51556729821095 + ) + : ((x245) ? ( + -3.2044944260569501*x177 - 3.9842086026737902 + ) + : ((x246) ? ( + -2.8708036109349*x177 - 5.8180212722081697 + ) + : ((x247) ? ( + -2.5116421712830301*x177 - 7.8000586835942203 + ) + : ((x248) ? ( + -1.80460257799325*x177 - 11.717290982141099 + ) + : ((x249) ? ( + -1.2668672637651099*x177 - 14.708971231798399 + ) + : ((x250) ? ( + -0.79591022376939702*x177 - 17.3394832839804 + ) + : ((x251) ? ( + -0.46499057072071498*x177 - 19.195100354748298 + ) + : ((x252) ? ( + -0.209402348965568*x177 - 20.6339111437137 + ) + : ((x253) ? ( + -0.13502175230019001*x177 - 21.054328599057001 + ) + : ((x254) ? ( + -0.10531027470347*x177 - 21.222909799636 + ) + : ((x255) ? ( + -0.15176894728551801*x177 - 20.958264643260001 + ) + : ((x256) ? ( + -0.30720854742526199*x177 - 20.069383027344902 + ) + : ((x257) ? ( + -0.40714833571678399*x177 - 19.495613552005999 + ) + : ((x258) ? ( + -0.57307801426975402*x177 - 18.539289797670801 + ) + : ((x259) ? ( + -0.45188722753414401*x177 - 19.2404184719007 + ) + : ((x260) ? ( + -0.34095283423994299*x177 - 19.884748832307199 + ) + : ((x261) ? ( + -0.101391790148568*x177 - 21.2813769497834 + ) + : ((x262) ? ( + 0.091439489485424005*x177 - 22.409918155988599 + ) + : ((x263) ? ( + 0.15775940896867299*x177 - 22.799513317144399 + ) + : ((x264) ? ( + 0.291644453598565*x177 - 23.589043734905299 + ) + : ((x265) ? ( + 0.218813788443072*x177 - 23.157953340330099 + ) + : ((x266) ? ( + 0.15493263193206999*x177 - 22.778402718590801 + ) + : ((x267) ? ( + 0.0130504257608663*x177 - 21.932247344509101 + ) + : ((x268) ? ( + -0.115959060276282*x177 - 21.159954790779899 + ) + : ((x269) ? ( + -0.286559975286309*x177 - 20.134882103548101 + ) + : ((x270) ? ( + -0.37967673216280701*x177 - 19.573445440206299 + ) + : ((x271) ? ( + -0.49173461909697402*x177 - 18.895150260382302 + ) + : ((x272) ? ( + -0.61785251318155998*x177 - 18.128915072198701 + ) + : ((x273) ? ( + -0.61044633705080298*x177 - 18.1740698616095 + ) + : ((x274) ? ( + -0.72608077731592902*x177 - 17.4663207209733 + ) + : ((x275) ? ( + -0.95925614440489004*x177 - 16.0339209898912 + ) + : ((x276) ? ( + -1.0585422967578799*x177 - 15.4218861130948 + ) + : ((x277) ? ( + -1.2909283589043501*x177 - 13.983992538329399 + ) + : ((x278) ? ( + -1.64666769221208*x177 - 11.775023806891101 + ) + : ((x279) ? ( + -1.8492714166259201*x177 - 10.5127116506501 + ) + : ((x280) ? ( + -1.94508032434487*x177 - 9.9136326316238392 + ) + : ((x281) ? ( + -2.22025076248815*x177 - 8.1865358869808897 + ) + : ((x282) ? ( + -2.4512780810855501*x177 - 6.7313287504994204 + ) + : ((x283) ? ( + -2.26962366535906*x177 - 7.8794112314080804 + ) + : ((x284) ? ( + -2.0863839597168399*x177 - 9.0415948965010102 + ) + : ((x285) ? ( + -2.0848607637183201*x177 - 9.0512907823276691 + ) + : ((x286) ? ( + -1.8841149811578399*x177 - 10.3335323515357 + ) + : ((x287 && x290) ? ( + -1.8564586978613999*x177 - 10.510807277904901 + ) + : ((x288 && x289) ? ( + -1.76263611112745*x177 - 11.1142144624864 + ) + : ((x291) ? ( + -1.67510434343274*x177 - 11.6790848242872 + ) + : ((x292) ? ( + -1.6102512791394501*x177 - 12.0990519442057 + ) + : ((x293) ? ( + -1.48362476308819*x177 - 12.921910369851499 + ) + : ((x294) ? ( + -1.4592525975119801*x177 - 13.0808446269721 + ) + : ((x295) ? ( + -1.2166884622729399*x177 - 14.6678994186832 + ) + : ((x296) ? ( + -1.1168280984404599*x177 - 15.323567370724 + ) + : ((x297) ? ( + -0.94975625448296297*x177 - 16.4241883891073 + ) + : ((x298) ? ( + -0.77301335024833395*x177 - 17.5923873008078 + ) + : ((x299) ? ( + -0.62030387509435103*x177 - 18.605226372878899 + ) + : ((x300) ? ( + -0.44263947976116902*x177 - 19.787436624632399 + ) + : ((x301) ? ( + -0.30863893367848*x177 - 20.682117214349098 + ) + : ((x302) ? ( + 0.37799839210128999*x177 - 25.2818800635869 + ) + : ((x303) ? ( + -0.17008626540336999*x177 - 21.609801798284899 + ) + : ((x304) ? ( + -0.089932065606262795*x177 - 22.148450789758499 + ) + : ((x305) ? ( + -0.045716866684188097*x177 - 22.446477266881601 + ) + : ((x306) ? ( + 0.082793220446092206*x177 - 23.315162770575601 + ) + : ((x307) ? ( + 0.13282407330507301*x177 - 23.654387828356398 + ) + : ((x308) ? ( + 0.192971992959656*x177 - 24.0633954479054 + ) + : ((x309) ? ( + 0.222438706333833*x177 - 24.264364369464602 + ) + : ((x310) ? ( + 0.21749138057339201*x177 - 24.230524136379199 + ) + : ((x311) ? ( + 0.235681934338345*x177 - 24.355306579581299 + ) + : ((x312) ? ( + 0.22767478025889401*x177 - 24.300215423578301 + ) + : ((x313) ? ( + 0.21777025474716499*x177 - 24.231875975386199 + ) + : ((x314) ? ( + 0.086589758180480203*x177 - 23.324090761140699 + ) + : ((x315) ? ( + 0.018425597582336199*x177 - 22.851030249067701 + ) + : ((x316) ? ( + -0.095740459339140202*x177 - 22.0564350821824 + ) + : ((x317) ? ( + -0.19764335706258901*x177 - 21.3451525125001 + ) + : ((x318) ? ( + -0.27723294135057602*x177 - 20.7880254224829 + ) + : ((x319) ? ( + -0.44605006323922702*x177 - 19.602728452778099 + ) + : ((x320) ? ( + -0.63447531976157701*x177 - 18.275952229802002 + ) + : ((x321) ? ( + -0.80470115977163903*x177 - 17.0740390088704 + ) + : ((x322) ? ( + -0.85228441879371497*x177 - 16.737188493977602 + ) + : ((x323) ? ( + -1.07382341232483*x177 - 15.1641795497126 + ) + : ((x324) ? ( + -1.2872963153461101*x177 - 13.6441299614416 + ) + : ((x325) ? ( + -1.31951487512265*x177 - 13.414093340298701 + ) + : ((x326) ? ( + -1.7572218101702199*x177 - 10.2795129012902 + ) + : ((x327) ? ( + -1.69560023572603*x177 - 10.721892763684099 + ) + : ((x328) ? ( + -1.6364113886490901*x177 - 11.1479729771627 + ) + : ((x329) ? ( + -1.78567380621826*x177 - 10.070282188830801 + ) + : ((x330) ? ( + -1.75913482356214*x177 - 10.2624389997509 + ) + : ((x331) ? ( + -1.65756359686497*x177 - 10.999853356538599 + ) + : ((x332) ? ( + -1.72248569929138*x177 - 10.5271533625 + ) + : ((x333) ? ( + -1.60840358124801*x177 - 11.3600703283028 + ) + : ((x334) ? ( + -1.4513062849268901*x177 - 12.5100455185275 + ) + : ((x335) ? ( + -1.4253694049277801*x177 - 12.700433736674301 + ) + : ((x336) ? ( + -1.32755370412065*x177 - 13.420341202203399 + ) + : ((x337) ? ( + -1.1339262834819701*x177 - 14.849352468705501 + ) + : ((x338) ? ( + -1.1065551671515499*x177 - 15.0518897989423 + ) + : ((x339) ? ( + -1.02493254608726*x177 - 15.657526035314699 + ) + : ((x340) ? ( + -0.95072251267038199*x177 - 16.209599163123102 + ) + : ((x341) ? ( + -0.82715174397685598*x177 - 17.131362026822899 + ) + : ((x342) ? ( + -0.79508175467935904*x177 - 17.371245769430999 + ) + : ((x343) ? ( + -0.67255991518800295*x177 - 18.2901212263987 + ) + : ((x344) ? ( + -0.63615655344483502*x177 - 18.563868245106299 + ) + : ((x345) ? ( + -0.626142986893228*x177 - 18.639373836120299 + ) + : ((x346) ? ( + -0.57224466133448004*x177 - 19.046840144590501 + ) + : ((x347) ? ( + -0.52916107670284895*x177 - 19.373404392665201 + ) + : ((x348) ? ( + -0.43011151089876898*x177 - 20.126169511116998 + ) + : ((x349) ? ( + -0.42072025584502598*x177 - 20.197732152355499 + ) + : ((x350) ? ( + -0.41661671872566303*x177 - 20.229085151537198 + ) + : ((x351) ? ( + -0.32955265151235802*x177 - 20.895988610429399 + ) + : ((x352) ? ( + -0.359007884565472*x177 - 20.669762537956601 + ) + : ((x353) ? ( + -0.29562802081954898*x177 - 21.157777203889101 + ) + : ((x354) ? ( + -0.26861239577874602*x177 - 21.366342132883801 + ) + : ((x355) ? ( + -0.27526591225455399*x177 - 21.314841502198799 + ) + : ((x356) ? ( + -0.22452734703983901*x177 - 21.708555915181901 + ) + : ((x357) ? ( + -0.228001616232405*x177 - 21.681524998437499 + ) + : ((x358) ? ( + -0.19406547980656799*x177 - 21.946227858898101 + ) + : ((x359) ? ( + -0.19896475340806299*x177 - 21.9079145523283 + ) + : ((x360) ? ( + -0.144045171554808*x177 - 22.338489900721498 + ) + : ((x361) ? ( + -0.18771268698606*x177 - 21.995274645596499 + ) + : ((x362) ? ( + -0.181371750917833*x177 - 22.045242754900801 + ) + : ((x363) ? ( + -0.15006926117553099*x177 - 22.292526805144 + ) + : ((x364) ? ( + -0.097468143190098999*x177 - 22.7091341466876 + ) + : ((x365) ? ( + -0.174341062052463*x177 - 22.098761775292601 + ) + : ((x366) ? ( + -0.12709908463625699*x177 - 22.4748076716787 + ) + : ((x367) ? ( + -0.173189984009014*x177 - 22.107002139286099 + ) + : ( + -9.9999999999999997e+98 + ))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))))*Z)*((0.5*X(10) + 0.25*X(11) + 0.25*X(12) + 0.25*X(18) + 0.5*X(19) + 0.75*X(20) + X(23) + 0.25*X(24) + 0.25*X(25) + 0.5*X(26) + 0.5*X(27) + 0.75*X(28) + 0.25*X(3) + 0.25*X(4) + 0.25*X(5) + 0.5*X(8))*(0.5*X(10) + 0.25*X(11) + 0.25*X(12) + 0.25*X(18) + 0.5*X(19) + 0.75*X(20) + X(23) + 0.25*X(24) + 0.25*X(25) + 0.5*X(26) + 0.5*X(27) + 0.75*X(28) + 0.25*X(3) + 0.25*X(4) + 0.25*X(5) + 0.5*X(8))) + (1 - x176)*(((x451 || x453 || x455 < 9.0) ? 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0.00036387813799999998*x503*x541 + 0.0029760547547000001*x503 + 9.7334827099999994e-5*x504 + 0.0011345025923*x505*x541 - 0.20926143712279999*x505 - 2.6366922300000002e-5*x506 + 0.0136346787342*x507 - 3.5612899999999997e-8*((x541)*(x541)*(x541)*(x541)*(x541)*(x541)*(x541)*(x541)*(x541)) - 0.118672054406*x541 - 0.050008209197199997*x542 - 0.85938724395099997*x543 + 0.25027983039980001*x544 - 0.0340585153781*x545 + 0.002684927785*x546 - 0.0001252971097*x547 + 3.2291785999999998e-6*x548 - 10.717982853902399)*X(27)*x448 + )) + ((x549 < -2.0 || x550 < 0.47712125 || x551 < -18.0) ? ( + 0.0 + ) + : ( + std::pow(10, -3.5355e-9*std::exp((10)*std::log(std::abs(x549))) + 0.0019497087522999999*x549*x550*x569 + 2.5033869e-6*x549*x550*x571 + 2.425819e-7*x549*x550*x572 + 2.74e-11*x549*x550*x575 - 0.25171915905909997*x549*x550 + 0.16154758856199999*x549*x551*x560 + 0.10319386725309999*x549*x551*x562 + 0.0091058356367999995*x549*x551*x564 + 7.0547189099999996e-5*x549*x551*x566 + 0.028910314039899999*x549*x551 + 0.00031554761819999999*x549*x560*x570 + 6.9799317000000001e-6*x549*x560*x571 - 8.3654700000000001e-8*x549*x560*x572 - 0.13936594077190001*x549*x560 + 0.0031773255127*x549*x561*x569 - 2.2029417000000002e-6*x549*x561*x571 + 3.32601e-8*x549*x561*x572 + 1.1211e-9*x549*x561*x573 + 0.40330227063039997*x549*x561 + 7.7272750100000005e-5*x549*x562*x570 + 4.3411179999999998e-7*x549*x562*x571 - 2.2911000000000001e-9*x549*x562*x572 + 0.053531392101600003*x549*x562 + 0.00074114505229999996*x549*x563*x569 - 0.4569416534031*x549*x563 + 7.4963150000000001e-7*x549*x564*x570 + 0.3477567512959*x549*x564 + 1.1028151899999999e-5*x549*x565*x569 - 0.11816708728189999*x549*x565 + 0.019397806516399999*x549*x566 - 0.0012520513382999999*x549*x567 + 0.00089752818999999998*x549*x569 + 8.7854088899999995e-5*x549*x570 - 1.36574957e-5*x549*x571 - 9.4252039999999997e-7*x549*x572 + 2.2287e-8*x549*x573 + 2.0822000000000001e-9*x549*x574 - 1.6900000000000001e-11*x549*x575 - 1.1e-12*x549*x576 - 5.0747599999999997e-8*x549*x581 - 0.092472151351600002*x549*x582 - 0.00022388895510000001*x549*x593 + 0.1098450355633*x549 + 0.0028626466126000002*std::exp((10)*std::log(std::abs(x550))) + 0.036943070713000001*x550*x551*x552 + 9.9116502200000001e-5*x550*x551*x555 + 1.5874459999999999e-7*x550*x551*x557 + 0.0208809736142*x550*x551 + 0.00074934921520000003*x550*x552*x569 - 2.1007040000000002e-6*x550*x552*x571 + 2.3848400000000001e-8*x550*x552*x572 + 1.7461e-9*x550*x552*x573 - 9.6999999999999995e-12*x550*x552*x574 + 0.12448499329609999*x550*x552 + 1.706318e-7*x550*x553*x571 - 2.0289999999999999e-9*x550*x553*x572 - 6.3199999999999999e-11*x550*x553*x573 + 0.0021851183530000001*x550*x553 + 9.2263300000000005e-6*x550*x554*x569 + 5.5200690000000001e-7*x550*x554*x570 - 7.8312e-9*x550*x554*x571 + 9.6999999999999995e-12*x550*x554*x572 + 0.0025381599434999998*x550*x554 - 2.020005e-7*x550*x555*x569 + 1.5340000000000001e-10*x550*x555*x571 - 0.0004386554592*x550*x555 + 9.9660000000000005e-10*x550*x556*x570 + 3.4105511399999997e-5*x550*x556 + 8.7899999999999996e-10*x550*x557*x569 - 5.5643800000000001e-8*x550*x557 - 2.6524680000000001e-7*x550*x558 + 1.29712e-8*x550*x559 + 0.12116895857649999*x550*x569 + 0.0042852113657000004*x550*x570 - 0.00031917813630000003*x550*x571 - 4.8222189999999996e-6*x550*x572 + 4.3293909999999998e-7*x550*x573 - 6.8428000000000004e-9*x550*x574 - 3.6380000000000003e-10*x550*x575 + 1.2200000000000001e-11*x550*x576 - 0.0001724768049*x550*x583 - 1.85014e-8*x550*x584 - 4.3599999999999999e-10*x550*x585 - 2.1681996300000001e-5*x550*x588 - 7.3379559800000005e-5*x550*x589 - 1.2760957e-6*x550*x590 - 3.5007499999999998e-8*x550*x591 + 2.3160339913389998*x550 - 9.0e-13*std::exp((10)*std::log(std::abs(x551))) + 0.0242280835853*x551*x552*x561 - 0.0073688190838000003*x551*x552*x562 + 0.00093238064600000004*x551*x552*x563 + 2.1883406499999999e-5*x551*x552*x564 - 1.1538743700000001e-5*x551*x552*x565 + 0.0027944244039999999*x551*x553*x560 + 0.00066004885729999997*x551*x553*x562 + 8.2064122999999992e-6*x551*x553*x564 + 0.00015823084750000001*x551*x554*x560 + 6.7963485999999997e-6*x551*x554*x561 - 4.6492789999999997e-6*x551*x554*x562 - 1.2901950000000001e-7*x551*x554*x563 + 0.00082868593670000002*x551*x554 + 1.112603e-6*x551*x555*x561 + 1.7737910000000001e-7*x551*x555*x562 - 5.5623862100000002e-5*x551*x555 + 9.0303320000000002e-7*x551*x556*x560 - 4.6753752e-6*x551*x556 - 1.2193400000000001e-8*x551*x557*x560 + 8.5708430000000003e-7*x551*x557 - 4.4505500000000001e-8*x551*x558 + 8.0859999999999998e-10*x551*x559 - 0.21663723691590001*x551*x560 + 0.1920547245942*x551*x561 + 0.11056734301350001*x551*x562 - 0.24899279055580001*x551*x563 + 0.15351117027309999*x551*x564 - 0.046268182456999998*x551*x565 + 0.0069910235136000001*x551*x566 - 0.00042396606349999998*x551*x567 - 2.02893876e-5*x551*x568 - 5.7396302000000004e-6*x551*x586 + 0.032905353185900002*x551 + 9.5462233999999995e-6*x552*x560*x570 + 2.5328600000000001e-7*x552*x560*x571 + 1.2e-9*x552*x560*x572 - 0.51226978719009997*x552*x560 + 0.00056809192320000001*x552*x561*x569 + 0.62437751308199996*x552*x561 + 1.7199399999999999e-8*x552*x562*x571 - 0.37407109166519997*x552*x562 + 4.1850417199999998e-5*x552*x563*x569 + 2.5775619999999998e-7*x552*x563*x570 + 0.11685657299130001*x552*x563 - 0.018009935602*x552*x564 + 0.00098798154369999992*x552*x565 + 2.0669974100000001e-5*x552*x566 + 1.3096201499999999e-5*x552*x570 + 1.7933759000000001e-6*x552*x571 - 2.9679800000000001e-8*x552*x572 - 4.7500000000000001e-10*x552*x573 + 6.1000000000000003e-12*x552*x574 - 2.9999999999999998e-13*x552*x575 - 2.0799999999999999e-11*x552*x580 - 1.7803739999999999e-7*x552*x593 + 0.063963953049699998*x552 - 1.1496e-9*x553*x560*x571 + 5.2320000000000001e-10*x553*x560*x572 + 0.017505307428100001*x553*x560 + 2.5435716e-6*x553*x561*x569 + 5.5091469999999995e-7*x553*x561*x570 - 1.7527e-9*x553*x561*x571 - 0.024079071690400002*x553*x561 + 0.018071886233*x553*x562 + 3.1931600000000003e-8*x553*x563*x569 - 0.0067334926452*x553*x563 + 0.0011495771008*x553*x564 - 7.1535481699999996e-5*x553*x565 + 9.6953757399999995e-5*x553*x569 + 4.3347996999999997e-6*x553*x570 + 3.7136899999999998e-8*x553*x571 + 1.5729999999999999e-10*x553*x572 - 2.5189999999999998e-10*x553*x573 - 9.0e-13*x553*x574 - 0.00042506434070000001*x553*x582 - 0.0020141106596*x553*x594 - 0.0090247676379999996*x553 + 2.7279999999999998e-10*x554*x560*x571 + 0.00013082126980000001*x554*x560 + 1.08747e-8*x554*x561*x570 - 9.8150547299999998e-5*x554*x561 + 1.7071000000000001e-8*x554*x562*x569 + 0.0002125030906*x554*x562 - 3.7537003600000001e-5*x554*x563 - 3.6726384000000002e-6*x554*x564 - 9.1657204000000005e-6*x554*x569 - 8.2257539999999999e-7*x554*x570 - 7.8846999999999995e-9*x554*x571 + 5.4019999999999995e-10*x554*x572 + 1.64e-11*x554*x573 - 0.00078838830499999998*x554*x582 - 1.14912e-7*x554*x597 - 0.0063418789521999998*x554 + 1.5290449999999999e-7*x555*x560*x569 - 1.9481793299999999e-5*x555*x561 + 1.7275312500000001e-5*x555*x562 + 2.6860743999999999e-6*x555*x563 + 9.0077900000000002e-8*x555*x569 + 3.12127e-8*x555*x570 - 1.026e-10*x555*x571 - 2.6600000000000001e-11*x555*x572 - 8.9480000000000001e-9*x555*x597 + 0.00074280899980000003*x555 - 1.8155e-9*x556*x560*x569 + 4.5213379300000001e-5*x556*x560 - 8.7344791e-6*x556*x561 - 1.3962928e-6*x556*x562 + 3.7880400000000001e-8*x556*x569 + 9.688e-10*x556*x570 + 1.1300000000000001e-11*x556*x571 - 6.0539900000000006e-8*x556*x594 - 2.2511410100000002e-5*x556 - 4.928726e-7*x557*x560 + 5.4556329999999998e-7*x557*x561 - 1.7335000000000001e-9*x557*x569 - 6.4400000000000005e-11*x557*x570 + 1.04782484e-5*x557 - 6.3537600000000001e-8*x558*x560 + 1.7300000000000001e-11*x558*x569 - 1.7361e-9*x558*x582 - 2.1144599000000001e-6*x558 + 1.4765149999999999e-7*x559 - 0.23243336161629999*x560*x569 - 0.0060047590352000002*x560*x570 + 0.00040085503570000001*x560*x571 + 7.2740530000000001e-6*x560*x572 - 1.2737000000000001e-9*x560*x574 - 1.7799999999999999e-11*x560*x575 - 0.041127044175299998*x560*x577 - 0.00070136213949999996*x560*x579 - 7.0284000000000003e-9*x560*x584 - 7.2e-12*x560*x585 - 5.9143245999999997e-6*x560*x589 - 1.1470484e-6*x560*x590 - 7.1189999999999999e-10*x560*x591 - 0.0035571581033999999*x560*x592 + 1.1160026329971999*x560 + 0.2431257553817*x561*x569 + 0.0041151083692999996*x561*x570 - 0.00027830134009999998*x561*x571 - 3.1120835000000001e-6*x561*x572 + 7.7286200000000006e-8*x561*x573 + 3.1390000000000002e-10*x561*x574 - 0.16738748127719999*x561*x587 - 0.55519169578280003*x561 - 0.15397014495149999*x562*x569 - 0.0016821148905000001*x562*x570 + 0.00010047376289999999*x562*x571 + 5.953574e-7*x562*x572 - 9.8590000000000008e-9*x562*x573 - 0.00021914885569999999*x562*x579 - 1.1690754000000001e-6*x562*x588 - 2.37214e-8*x562*x589 - 9.4609900000000006e-8*x562*x590 - 0.0020150238596*x562*x592 - 1.0529487515022*x562 + 0.0612481890093*x563*x569 + 0.0004202885447*x563*x570 - 4.5542200000000003e-8*x563*x572 - 0.0001096246207*x563*x578 - 1.27390263e-5*x563*x583 - 0.039115478906500002*x563*x587 + 0.13827178873939999*x563 - 0.014958490725999999*x564*x569 - 5.9086323300000002e-5*x564*x570 + 1.4636716e-6*x564*x571 - 3.3338918999999998e-6*x564*x579 - 0.0001417281462*x564*x592 + 1.0378186719538001*x564 + 0.0020487853523*x565*x569 + 3.5730467999999999e-6*x565*x570 - 0.0012093420751*x565*x587 - 0.83956762642930005*x565 - 0.0001203960609*x566*x569 + 0.28381726714819999*x566 - 0.045602120043099999*x567 - 0.00034135580390000001*x568 - 2.4955399999999999e-8*x569*x586 - 1.5002941e-6*x569*x595 - 0.030726740117700001*x569 - 4.8511999999999998e-8*x570*x595 - 0.0014092586279*x570 - 9.52185e-8*x571*x596 + 0.00019874633390000001*x571 - 1.8476999999999999e-9*x572*x596 + 4.6423740000000004e-6*x572 - 7.9429120000000001e-7*x573 - 1.0256300000000001e-8*x574 + 1.4564000000000001e-9*x575 + 7.7999999999999999e-12*x576 - 0.0142476868124*x577 - 0.0020219335184000001*x578 - 0.000655172836*x579 - 1.821314e-7*x580 - 1.88829785e-5*x581 - 27.169728828167202)*X(30)*x448 + )) + ((x368) ? ( + dustSemenov_cooling + ) + : ( + 0 + )) + ((X(16) >= 1.0000000000000001e-15) ? ( + -3.0219623423999999e-20*X(16)*x374/(-2.8000000000000003e-6*x371 - 5.7954876805999204e-10*x373 - x374 - 2.3999999999999999e-6) + ) + : ( + 0 + )) + ((X(21) >= 1.0000000000000001e-15) ? ( + 2.7161410787712002e-16*x381*(-x375*x376 - x377*x378) + 9.0605684176581105e-16*x381*(-1.2999999999999999e-11*((x370)*(x370))*1.0/x4*std::exp(-38603.200000000004*x6) + x378*x380) + ) + : ( + 0 + )) + ((X(22) >= 1.0000000000000001e-15) ? ( + 2.8261864559999996e-18*x406*(-x387*x396 - x401*x402) + 2.4852256297992001e-19*x406*(x396*x405 - x401*x404) + ) + : ( + 0 + )) + ((X(17) >= 1.0000000000000001e-15) ? ( + 2.6177086079999999e-22*x447*(-x418*x431 - x441*x442) + 1.4538225266597305e-21*x447*(x431*x446 - x441*x445) + ) + : ( + 0 + ))) +) +: ( + 0 +)) + 0.00084373771595996178*x4*(1.3806479999999999e-16*X(0) + 1.3806479999999999e-16*X(1) + 1.3806479999999999e-16*X(10) + 1.3806479999999999e-16*X(11) + 1.3806479999999999e-16*X(12) + 1.3806479999999999e-16*X(13) + 1.3806479999999999e-16*X(14) + 1.3806479999999999e-16*X(15) + 1.3806479999999999e-16*X(16) + 1.3806479999999999e-16*X(17) + 1.3806479999999999e-16*X(18) + 1.3806479999999999e-16*X(19) + 1.3806479999999999e-16*X(2) + 1.3806479999999999e-16*X(20) + 1.3806479999999999e-16*X(21) + 1.3806479999999999e-16*X(22) + 1.3806479999999999e-16*X(23) + 1.3806479999999999e-16*X(24) + 1.3806479999999999e-16*X(25) + 1.3806479999999999e-16*X(26) + 1.3806479999999999e-16*X(27) + 1.3806479999999999e-16*X(28) + 1.3806479999999999e-16*X(29) + 1.3806479999999999e-16*X(3) + 1.3806479999999999e-16*X(30) + 1.3806479999999999e-16*X(31) + 1.3806479999999999e-16*X(32) + 1.3806479999999999e-16*X(33) + 1.3806479999999999e-16*X(4) + 1.3806479999999999e-16*X(5) + 1.3806479999999999e-16*X(6) + 1.3806479999999999e-16*X(7) + 1.3806479999999999e-16*X(8) + 1.3806479999999999e-16*X(9))/(std::sqrt(x1)*x35))); +} + + +AMREX_GPU_HOST_DEVICE AMREX_INLINE +Real interpolate_2d(Real const x, Real const y, const Array1D& xArray, const Array1D& yArray, const Array2D& zArray) { + + // Helper function to perform binary search + auto binary_search = [](const auto& arr, Real value) { + int low = 1; + int high = arr.size(); + while (low <= high) { + int mid = low + (high - low) / 2; + if (value < arr(mid)) { + high = mid - 1; + } else if (value > arr(mid + 1)) { + low = mid + 1; + } else { + return std::make_pair(mid, mid + 1); + } + } + // If the exact range is not found, return the closest valid indices + return std::make_pair(high, high + 1); + }; + + // Find the right x indices using binary search + auto [x1_idx, x2_idx] = binary_search(xArray, x); + + // Find the right y indices using binary search + auto [y1_idx, y2_idx] = binary_search(yArray, y); + + // Interpolate in x direction + Real x1 = xArray(x1_idx); + Real x2 = xArray(x2_idx); + + Real z_x1_y1 = zArray(x1_idx, y1_idx); + Real z_x2_y1 = zArray(x2_idx, y1_idx); + Real z_x_y1 = (z_x2_y1 - z_x1_y1) / (x2 - x1) * (x - x1) + z_x1_y1; + + Real z_x1_y2 = zArray(x1_idx, y2_idx); + Real z_x2_y2 = zArray(x2_idx, y2_idx); + Real z_x_y2 = (z_x2_y2 - z_x1_y2) / (x2 - x1) * (x - x1) + z_x1_y2; + + // Interpolate in y direction + Real y1 = yArray(y1_idx); + Real y2 = yArray(y2_idx); + Real z_xy = (z_x_y2 - z_x_y1) / (y2 - y1) * (y - y1) + z_x_y1; + + return z_xy; +} + +AMREX_GPU_HOST_DEVICE AMREX_INLINE +std::pair compute_Semenov_Tdust(Real Tgas, const Array1D& composition, Real const user_dust2gas_ratio, Real const z, + Real krome_Semenov_Tdust, Array1D& s_x, Array1D& s_y, + Array2D& s_z) { + + Real dustSemenov_cooling = 0.0; + + if (user_dust2gas_ratio == 0) { + return std::make_pair(krome_Semenov_Tdust, dustSemenov_cooling); + } + + Tgas = std::max(Tgas, 2.73 * (1.0 + z)); + + Array1D mass; + mass(0) = 0.0; + mass(1) = 0.0; + mass(2) = 9.10938188e-28; + mass(3) = 1.67262158e-24; + mass(4) = 1.673532518188e-24; + mass(5) = 1.6744434563759998e-24; + mass(6) = 3.34512158e-24; + mass(7) = 3.346032518188e-24; + mass(8) = 3.346154098188e-24; + mass(9) = 3.346943456376e-24; + mass(10) = 3.347065036376e-24; + mass(11) = 5.0186540981880006e-24; + mass(12) = 5.0195650363760004e-24; + mass(13) = 6.690243159999999e-24; + mass(14) = 6.691154098188e-24; + mass(15) = 6.692065036376e-24; + mass(16) = 2.007528417094e-23; + mass(17) = 2.0076195109128e-23; + mass(18) = 2.1749727627316e-23; + mass(19) = 2.3423260145503998e-23; + mass(20) = 2.5096792663692e-23; + mass(21) = 2.6767349207316e-23; + mass(22) = 2.6768260145504e-23; + mass(23) = 2.677032518188e-23; + mass(24) = 2.8440881725504e-23; + mass(25) = 2.8441792663692003e-23; + mass(26) = 3.0114414243692e-23; + mass(27) = 3.011532518188e-23; + mass(28) = 3.178794676188e-23; + mass(29) = 4.6843544316444e-23; + mass(30) = 4.6844455254632e-23; + mass(31) = 5.353560935282e-23; + mass(32) = 5.3536520291008e-23; + mass(33) = 7.3612715400136e-23; + + Real rhogas = 0.0; + Real sum_comp = 0.0; + for (int i = 0; i < NumSpec; ++i) { + rhogas += composition(i) * mass(i); + sum_comp += composition(i); + } + rhogas = std::max(rhogas, 1e-40); + + Real nH = 0.0; + nH = composition(3) + composition(4) + composition(5) + composition(10) * 2.0 + composition(8) * 2.0 + + composition(25) + composition(18) + composition(19) * 2.0 + composition(20) * 3.0 + + composition(27) * 2.0 + composition(23) * 4.0 + composition(24) + composition(26) * 2.0 + + composition(28) * 3.0 + composition(11) + composition(12); + + //std::cout << "compute semenov tdust nH: " << nH << std::endl; + + Real clipped_x = std::max(-18.0, std::min(std::log10(rhogas), -7.0)); + Real clipped_y = std::max(1e1, std::min(Tgas, 1e4)); + + auto kappaP = interpolate_2d(clipped_x, clipped_y, s_x, s_y, s_z); + //std::cout << "compute semenov clipx = " << clipped_x << ", clipy = " << clipped_y << ", " << "kappaP = " << kappaP << std::endl; + + Real mu = rhogas / std::max(sum_comp, 1e-40) * (1.0/C::m_p); + Real ljeans = std::sqrt(M_PI * C::k_B * Tgas / rhogas / C::m_p / C::Gconst / mu); + + Real tau_d = rhogas * kappaP * user_dust2gas_ratio; + Real tau_g = 0.0; + Real tau = (tau_d + tau_g) * ljeans; + + Real besc = (tau < 1.0) ? 1.0 : amrex::Math::powi<-2>(tau); + + Real const alpha_gd = 3.2e-34; + Real const aR = 4 * C::sigma_SB / C::c_light; + + kappaP *= besc; + + Real intJRad = 0.0; + + Real A = rhogas * kappaP * user_dust2gas_ratio * aR * C::c_light; + Real B = std::pow(Tgas, 0.5) * amrex::Math::powi<2>(nH) * alpha_gd * user_dust2gas_ratio; + Real phys_Tcmb = 2.73 * (1.0 + z); + Real C = -1.0 * (intJRad + A * amrex::Math::powi<4>(phys_Tcmb) + std::pow(Tgas, 1.5) * amrex::Math::powi<2>(nH) * alpha_gd * user_dust2gas_ratio); + + Real Tdold = krome_Semenov_Tdust; + Real Tdnew = 0.0; + + for (int iterr = 0; iterr <= 1001; ++iterr) { + Real fx = A * amrex::Math::powi<4>(Tdold) + B * Tdold + C; + Real fdash_x = 4.0 * A * amrex::Math::powi<3>(Tdold) + B; + + Tdnew = Tdold - fx / fdash_x; + Real rel_t = std::abs((Tdnew - Tdold) / Tdold); + Real abs_t = std::abs(Tdnew - Tdold); + Tdold = Tdnew; + + if (abs_t < 1e-8 || rel_t < 1e-5) { + break; + } + + if (iterr > 1000) { + amrex::Error("Maximum iterations reached in dust temperature NR-solver. Tgas = " + + std::to_string(Tgas) + + ", Tdold_start = " + + std::to_string(krome_Semenov_Tdust) + + ", Tdnew = " + + std::to_string(Tdnew)); + } + } + + dustSemenov_cooling = A * amrex::Math::powi<4>(Tdnew) - intJRad - A * amrex::Math::powi<4>(phys_Tcmb); + + return std::make_pair(Tdnew, dustSemenov_cooling); +} + +AMREX_GPU_HOST_DEVICE AMREX_INLINE +void actual_rhs (burn_t& state, Array1D& ydot) +{ + + Real z = redshift; + Real Z = metallicity; + + Array1D X; + for (int i = 0; i < NumSpec; ++i) { + X(i) = state.xn[i]; + } + + Real krome_Semenov_Tdust = state.aux[0]; + + // Call the compute_Semenov_Tdust function + auto result = compute_Semenov_Tdust(state.T, X, dust2gas_ratio, z, krome_Semenov_Tdust, semenov_x, semenov_y, semenov_z); + // compute Tdust + Real Tdust = result.first; + // store Tdust in aux + state.aux[0] = result.first; + Real dustSemenov_cooling = result.second; + + // YDOTS + + rhs_specie(state, ydot, X, crate, Av, ionH, ionH2, dissH2, + ionC, ionO, dissCO, dust2gas_ratio, Tdust, z); + + // Edot + + Real edot = rhs_eint(state, X, crate, Av, ionH, ionH2, dissH2, + ionC, ionO, dissCO, dust2gas_ratio, Tdust, dustSemenov_cooling, z, Z); + + // Append the energy equation (this is erg/g/s) + + ydot(net_ienuc) = edot; + +} + + +template +AMREX_GPU_HOST_DEVICE AMREX_INLINE +void actual_jac(const burn_t& state, MatrixType& jac) +{ + + Array1D X; + for (int i = 0; i < NumSpec; ++i) { + X(i) = state.xn[i]; + } + + // initialize + jac.zero(); + +} + + +AMREX_INLINE +void actual_rhs_init () { + + +} + + +#endif diff --git a/networks/metal_chem/pynucastro.net b/networks/metal_chem/pynucastro.net new file mode 100644 index 0000000000..61548dc74b --- /dev/null +++ b/networks/metal_chem/pynucastro.net @@ -0,0 +1,35 @@ +co_ice CO_ice 1.0 1.0 +h2o_ice H2O_ice 1.0 1.0 +elec E 1.0 1.0 +hp Hp 4.0 2.0 +h H 12.0 6.0 +hm Hm 13.0 6.0 +dp Dp 13.0 7.0 +d D 14.0 7.0 +h2p H2p 15.0 7.0 +dm Dm 14.0 8.0 +h2 H2 15.0 8.0 +hdp HDp 16.0 8.0 +hd HD 17.0 8.0 +hepp HEpp 17.0 9.0 +hep HEp 18.0 9.0 +he HE 4.0 2.0 +cp Cp 4.0 2.0 +c Carbon 4.0 2.0 +ch CH 4.0 2.0 +ch2 CH2 4.0 2.0 +ch3 CH3 4.0 2.0 +op Op 4.0 2.0 +o O 4.0 2.0 +ch4 CH4 4.0 2.0 +ohp OHp 4.0 2.0 +oh OH 4.0 2.0 +h2op H2Op 4.0 2.0 +h2o H2O 4.0 2.0 +h3op H3Op 4.0 2.0 +cop COp 4.0 2.0 +co CO 4.0 2.0 +o2p O2p 4.0 2.0 +o2 O2 4.0 2.0 +co2 CO2 4.0 2.0 +__aux_Tdust diff --git a/networks/primordial_chem/actual_network.H b/networks/primordial_chem/actual_network.H index 9c01915759..7f0f573b67 100644 --- a/networks/primordial_chem/actual_network.H +++ b/networks/primordial_chem/actual_network.H @@ -6,6 +6,7 @@ #include #include +#include using namespace amrex; @@ -26,4 +27,6 @@ namespace Rates } +void balance_charge(burn_t& state); + #endif diff --git a/networks/primordial_chem/actual_network_data.cpp b/networks/primordial_chem/actual_network_data.cpp index 4d65a7996a..5c4665a6c2 100644 --- a/networks/primordial_chem/actual_network_data.cpp +++ b/networks/primordial_chem/actual_network_data.cpp @@ -10,3 +10,12 @@ void actual_network_init() { } + +void balance_charge(burn_t& state) +{ + + // update the number density of electrons due to charge conservation + state.xn[0] = -state.xn[3] - state.xn[7] + state.xn[1] + state.xn[12] + + state.xn[6] + state.xn[4] + state.xn[9] + 2.0 * state.xn[11]; + +} diff --git a/unit_test/CMakeLists.txt b/unit_test/CMakeLists.txt index 91de0ff424..7310d8ace1 100644 --- a/unit_test/CMakeLists.txt +++ b/unit_test/CMakeLists.txt @@ -1,5 +1,13 @@ -#add primordial_chem test -add_subdirectory(burn_cell_primordial_chem) + +if(BUILD_UNIT_TEST_PC) + #add primordial_chem test + add_subdirectory(burn_cell_primordial_chem) +endif() + +if(BUILD_UNIT_TEST_MC) + #add metal_chem test + add_subdirectory(burn_cell_metal_chem) +endif() #uncomment below if you want to see the values of all CMAKE variables #get_cmake_property(_variableNames VARIABLES) diff --git a/unit_test/burn_cell_metal_chem/CMakeLists.txt b/unit_test/burn_cell_metal_chem/CMakeLists.txt new file mode 100644 index 0000000000..2ffd64362b --- /dev/null +++ b/unit_test/burn_cell_metal_chem/CMakeLists.txt @@ -0,0 +1,17 @@ +#all .cpp files that need to be compiled for the test go here +add_executable(test_burn_cell_metal_chem main.cpp ${metal_chem_sources}) + +#test needs to find burn_cell.H, unit_test.H, and extern_parameters.H +target_include_directories(test_burn_cell_metal_chem PUBLIC ${CMAKE_CURRENT_SOURCE_DIR} "includes/burn_cell.H" + ${CMAKE_CURRENT_SOURCE_DIR}/../ "includes/unit_test.H" ${CMAKE_BINARY_DIR} "includes/extern_parameters.H") + +#below line will add NAUX_NET and STRANG compiler flags +#these are needed for preprocessor variables +target_compile_definitions(test_burn_cell_metal_chem PUBLIC NAUX_NET STRANG) + + +if(AMReX_GPU_BACKEND MATCHES "CUDA") + setup_target_for_cuda_compilation(test_burn_cell_metal_chem) +endif(AMReX_GPU_BACKEND MATCHES "CUDA") + +add_test(NAME burn_cell_metal_chem COMMAND test_burn_cell_metal_chem inputs_metal_chem WORKING_DIRECTORY ${CMAKE_CURRENT_SOURCE_DIR}) diff --git a/unit_test/burn_cell_metal_chem/GNUmakefile b/unit_test/burn_cell_metal_chem/GNUmakefile new file mode 100644 index 0000000000..09e7a10c62 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/GNUmakefile @@ -0,0 +1,40 @@ +PRECISION = DOUBLE +PROFILE = FALSE + +# Set DEBUG to TRUE if debugging +DEBUG = TRUE + +DIM = 1 + +COMP = gnu + +USE_MPI = FALSE +USE_OMP = FALSE +#set USE_CUDA to TRUE to compile and run on GPUs +USE_CUDA = FALSE +USE_REACT = TRUE + +# Set USE_MICROPHYSICS_DEBUG to TRUE if debugging +USE_MICROPHYSICS_DEBUG = TRUE + +EBASE = main + +# define the location of the Microphysics top directory +MICROPHYSICS_HOME := ../.. + +# This sets the EOS directory +EOS_DIR := metal_chem + +# This sets the network directory +NETWORK_DIR := metal_chem + +CONDUCTIVITY_DIR := stellar + +INTEGRATOR_DIR = VODE + +EXTERN_SEARCH += . + +Bpack := ./Make.package +Blocs := . + +include $(MICROPHYSICS_HOME)/unit_test/Make.unit_test diff --git a/unit_test/burn_cell_metal_chem/Make.package b/unit_test/burn_cell_metal_chem/Make.package new file mode 100644 index 0000000000..a58b0ccabf --- /dev/null +++ b/unit_test/burn_cell_metal_chem/Make.package @@ -0,0 +1,2 @@ +CEXE_sources += main.cpp +CEXE_headers += burn_cell.H diff --git a/unit_test/burn_cell_metal_chem/README.md b/unit_test/burn_cell_metal_chem/README.md new file mode 100644 index 0000000000..c27195026b --- /dev/null +++ b/unit_test/burn_cell_metal_chem/README.md @@ -0,0 +1,24 @@ +#Authors: Piyush Sharda (Leiden) 2024 + +# burn_cell_metal_chem + +`burn_cell_metal_chem` integrates a primordial+metal ISM chemistry network + for a single set of initial conditions. The density, temperature, and composition + are set in the inputs file, as well as the maximum time to integrate. + This test does not include cosmic rays and photochemistry. + + Upon completion, the new state is printed to the screen. + +# key difference with other tests + + For metal chemistry, state.xn is always assumed to contain + number densities. We work with number densities and not mass fractions + because our equations are very stiff (stiffness ratios are as high as 1e31) + because y/ydot (natural timescale for a species abundance to vary) can be + very different (by factors ~ 1e30) for different species. + However, state.rho still contains the density in g/cm^3, and state.e + still contains the specific internal energy in erg/g/K. + +# continuous integration + +The code is built with the `metal_chem` network and run with `inputs_metal_chem`. diff --git a/unit_test/burn_cell_metal_chem/Semenov_PlanckOpacity.dat b/unit_test/burn_cell_metal_chem/Semenov_PlanckOpacity.dat new file mode 100644 index 0000000000..7ec373d271 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/Semenov_PlanckOpacity.dat @@ -0,0 +1,10004 @@ +##Semenov dust opacities from Semenov+2003 +##Provided by Shyam Menon (2024) +##log10(Rhogas) (g/cm^3) Tgas (K) PlanckOPacity (cm^2/g) +10,1000 +-1.8000E+01 1.0000E+01 1.0158E-01 +-1.8000E+01 1.0069E+01 1.0306E-01 +-1.8000E+01 1.0139E+01 1.0455E-01 +-1.8000E+01 1.0210E+01 1.0606E-01 +-1.8000E+01 1.0280E+01 1.0759E-01 +-1.8000E+01 1.0352E+01 1.0915E-01 +-1.8000E+01 1.0424E+01 1.1072E-01 +-1.8000E+01 1.0496E+01 1.1232E-01 +-1.8000E+01 1.0569E+01 1.1394E-01 +-1.8000E+01 1.0642E+01 1.1557E-01 +-1.8000E+01 1.0716E+01 1.1724E-01 +-1.8000E+01 1.0790E+01 1.1892E-01 +-1.8000E+01 1.0865E+01 1.2063E-01 +-1.8000E+01 1.0941E+01 1.2236E-01 +-1.8000E+01 1.1016E+01 1.2411E-01 +-1.8000E+01 1.1093E+01 1.2589E-01 +-1.8000E+01 1.1170E+01 1.2769E-01 +-1.8000E+01 1.1247E+01 1.2951E-01 +-1.8000E+01 1.1325E+01 1.3136E-01 +-1.8000E+01 1.1404E+01 1.3323E-01 +-1.8000E+01 1.1483E+01 1.3513E-01 +-1.8000E+01 1.1563E+01 1.3706E-01 +-1.8000E+01 1.1643E+01 1.3901E-01 +-1.8000E+01 1.1724E+01 1.4098E-01 +-1.8000E+01 1.1805E+01 1.4299E-01 +-1.8000E+01 1.1887E+01 1.4502E-01 +-1.8000E+01 1.1970E+01 1.4707E-01 +-1.8000E+01 1.2053E+01 1.4916E-01 +-1.8000E+01 1.2136E+01 1.5127E-01 +-1.8000E+01 1.2220E+01 1.5341E-01 +-1.8000E+01 1.2305E+01 1.5557E-01 +-1.8000E+01 1.2391E+01 1.5777E-01 +-1.8000E+01 1.2477E+01 1.6000E-01 +-1.8000E+01 1.2563E+01 1.6225E-01 +-1.8000E+01 1.2650E+01 1.6454E-01 +-1.8000E+01 1.2738E+01 1.6685E-01 +-1.8000E+01 1.2826E+01 1.6920E-01 +-1.8000E+01 1.2915E+01 1.7157E-01 +-1.8000E+01 1.3005E+01 1.7398E-01 +-1.8000E+01 1.3095E+01 1.7642E-01 +-1.8000E+01 1.3186E+01 1.7890E-01 +-1.8000E+01 1.3278E+01 1.8140E-01 +-1.8000E+01 1.3370E+01 1.8394E-01 +-1.8000E+01 1.3463E+01 1.8651E-01 +-1.8000E+01 1.3556E+01 1.8911E-01 +-1.8000E+01 1.3650E+01 1.9175E-01 +-1.8000E+01 1.3745E+01 1.9443E-01 +-1.8000E+01 1.3840E+01 1.9713E-01 +-1.8000E+01 1.3936E+01 1.9988E-01 +-1.8000E+01 1.4033E+01 2.0266E-01 +-1.8000E+01 1.4130E+01 2.0547E-01 +-1.8000E+01 1.4228E+01 2.0833E-01 +-1.8000E+01 1.4327E+01 2.1122E-01 +-1.8000E+01 1.4426E+01 2.1414E-01 +-1.8000E+01 1.4527E+01 2.1711E-01 +-1.8000E+01 1.4627E+01 2.2011E-01 +-1.8000E+01 1.4729E+01 2.2316E-01 +-1.8000E+01 1.4831E+01 2.2624E-01 +-1.8000E+01 1.4934E+01 2.2936E-01 +-1.8000E+01 1.5038E+01 2.3252E-01 +-1.8000E+01 1.5142E+01 2.3573E-01 +-1.8000E+01 1.5247E+01 2.3897E-01 +-1.8000E+01 1.5353E+01 2.4226E-01 +-1.8000E+01 1.5459E+01 2.4559E-01 +-1.8000E+01 1.5567E+01 2.4896E-01 +-1.8000E+01 1.5675E+01 2.5238E-01 +-1.8000E+01 1.5783E+01 2.5584E-01 +-1.8000E+01 1.5893E+01 2.5934E-01 +-1.8000E+01 1.6003E+01 2.6289E-01 +-1.8000E+01 1.6114E+01 2.6649E-01 +-1.8000E+01 1.6226E+01 2.7013E-01 +-1.8000E+01 1.6339E+01 2.7381E-01 +-1.8000E+01 1.6452E+01 2.7755E-01 +-1.8000E+01 1.6566E+01 2.8133E-01 +-1.8000E+01 1.6681E+01 2.8516E-01 +-1.8000E+01 1.6797E+01 2.8904E-01 +-1.8000E+01 1.6913E+01 2.9297E-01 +-1.8000E+01 1.7031E+01 2.9695E-01 +-1.8000E+01 1.7149E+01 3.0098E-01 +-1.8000E+01 1.7268E+01 3.0506E-01 +-1.8000E+01 1.7388E+01 3.0919E-01 +-1.8000E+01 1.7508E+01 3.1338E-01 +-1.8000E+01 1.7630E+01 3.1761E-01 +-1.8000E+01 1.7752E+01 3.2190E-01 +-1.8000E+01 1.7875E+01 3.2625E-01 +-1.8000E+01 1.7999E+01 3.3065E-01 +-1.8000E+01 1.8124E+01 3.3510E-01 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mode 100644 index 0000000000..4d602783fc --- /dev/null +++ b/unit_test/burn_cell_metal_chem/_parameters @@ -0,0 +1,58 @@ +@namespace: unit_test + +run_prefix string "burn_cell_metal_chem" + +# floor values of temperature and density +small_temp real 1.e1 +small_dens real 1.e-30 + +# the final time to integrate to +tmax real 1.e20 +# tff_reduc reduces the calculated freefall time to accordingly increase the density during the single zone burn +tff_reduc real 1.e-1 + +# first output time -- we will output in nsteps logarithmically spaced steps between [tfirst, tmax] +tfirst real 0.0 + +# number of steps for the single zone burn +nsteps int 1000 + +# initial number density and temperature +ninit real 1e-1 +temperature real 1e2 + +#list of species and their number densities used in the network (39 if including deuterium) +primary_species_1 real 1.0e0 +primary_species_2 real 0.0e0 +primary_species_3 real 0.0e0 +primary_species_4 real 0.0e0 +primary_species_5 real 0.0e0 +primary_species_6 real 0.0e0 +primary_species_7 real 0.0e0 +primary_species_8 real 0.0e0 +primary_species_9 real 0.0e0 +primary_species_10 real 0.0e0 +primary_species_11 real 0.0e0 +primary_species_12 real 0.0e0 +primary_species_13 real 0.0e0 +primary_species_14 real 0.0e0 +primary_species_15 real 0.0e0 +primary_species_16 real 0.0e0 +primary_species_17 real 0.0e0 +primary_species_18 real 0.0e0 +primary_species_19 real 0.0e0 +primary_species_20 real 0.0e0 +primary_species_21 real 0.0e0 +primary_species_22 real 0.0e0 +primary_species_23 real 0.0e0 +primary_species_24 real 0.0e0 +primary_species_25 real 0.0e0 +primary_species_26 real 0.0e0 +primary_species_27 real 0.0e0 +primary_species_28 real 0.0e0 +primary_species_29 real 0.0e0 +primary_species_30 real 0.0e0 +primary_species_31 real 0.0e0 +primary_species_32 real 0.0e0 +primary_species_33 real 0.0e0 +primary_species_34 real 0.0e0 diff --git a/unit_test/burn_cell_metal_chem/burn_cell.H b/unit_test/burn_cell_metal_chem/burn_cell.H new file mode 100644 index 0000000000..6adf645455 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/burn_cell.H @@ -0,0 +1,368 @@ +#ifndef BURN_CELL_H +#define BURN_CELL_H + +#include +#include + +#include +#include +#include +#include +#include + +amrex::Real grav_constant = C::Gconst; + +AMREX_INLINE +auto burn_cell_c() -> int { + + using namespace unit_test_rp; + + burn_t state; + + amrex::Real numdens[NumSpec] = {-1.0}; + int n; + int x; + int nn; + + amrex::Real metal = network_rp::metallicity; + + for (n = 1; n <= NumSpec; ++n) { + switch (n) { + + case 1: + numdens[n - 1] = primary_species_1; + break; + case 2: + numdens[n - 1] = primary_species_2; + break; + case 3: + numdens[n - 1] = primary_species_3; + break; + case 4: + numdens[n - 1] = primary_species_4; + break; + case 5: + numdens[n - 1] = primary_species_5; + break; + case 6: + numdens[n - 1] = primary_species_6; + break; + case 7: + numdens[n - 1] = primary_species_7; + break; + case 8: + numdens[n - 1] = primary_species_8; + break; + case 9: + numdens[n - 1] = primary_species_9; + break; + case 10: + numdens[n - 1] = primary_species_10; + break; + case 11: + numdens[n - 1] = primary_species_11; + break; + case 12: + numdens[n - 1] = primary_species_12; + break; + case 13: + numdens[n - 1] = primary_species_13; + break; + case 14: + numdens[n - 1] = primary_species_14; + break; + case 15: + numdens[n - 1] = primary_species_15; + break; + case 16: + numdens[n - 1] = primary_species_16; + break; + case 17: + numdens[n - 1] = primary_species_17*metal; + break; + case 18: + numdens[n - 1] = primary_species_18; + break; + case 19: + numdens[n - 1] = primary_species_19; + break; + case 20: + numdens[n - 1] = primary_species_20; + break; + case 21: + numdens[n - 1] = primary_species_21; + break; + case 22: + numdens[n - 1] = primary_species_22; + break; + case 23: + numdens[n - 1] = primary_species_23*metal; + break; + case 24: + numdens[n - 1] = primary_species_24; + break; + case 25: + numdens[n - 1] = primary_species_25; + break; + case 26: + numdens[n - 1] = primary_species_26; + break; + case 27: + numdens[n - 1] = primary_species_27; + break; + case 28: + numdens[n - 1] = primary_species_28; + break; + case 29: + numdens[n - 1] = primary_species_29; + break; + case 30: + numdens[n - 1] = primary_species_30; + break; + case 31: + numdens[n - 1] = primary_species_31; + break; + case 32: + numdens[n - 1] = primary_species_32; + break; + case 33: + numdens[n - 1] = primary_species_33; + break; + case 34: + numdens[n - 1] = primary_species_34; + break; + } + } + + //scale number densities by initial ninit + for (n = 0; n < NumSpec; ++n) { + numdens[n] *= ninit; + } + + //if metallicity is 0, reset metal number densities to 0 + if (metal == 0) { + for (n = 0; n < NumSpec; ++n) { + if ((n < 2) || (n > 15)) { + state.xn[n] = 0.0; + } + } + } + + + // Echo initial conditions at burn and fill burn state input + + std::cout << "Redshift: " << network_rp::redshift << std::endl; + std::cout << "Metallicity: " << metal << std::endl; + std::cout << "Dust2gas Ratio: " << network_rp::dust2gas_ratio << std::endl; + std::cout << " " << std::endl; + + std::cout << "Maximum Time (s): " << tmax << std::endl; + std::cout << "State Temperature (K): " << temperature << std::endl; + for (n = 0; n < NumSpec; ++n) { + std::cout << "Number Density input (" << short_spec_names_cxx[n] + << "): " << numdens[n] << std::endl; + } + + amrex::Real TCMB = 2.73*(1.0 + network_rp::redshift); + state.T = amrex::max(temperature, TCMB); + // set initial Tdust to CMB + state.aux[0] = TCMB; + + // find the density in g/cm^3 + amrex::Real rhotot = 0.0_rt; + amrex::Real sum_numdens = 0.0_rt; + for (n = 0; n < NumSpec; ++n) { + state.xn[n] = numdens[n]; + rhotot += state.xn[n] * spmasses[n]; // spmasses contains the masses of all + // species, defined in EOS + sum_numdens += state.xn[n]; + } + + state.rho = rhotot; + std::cout << "rho: " << rhotot << ", dd: " << sum_numdens << std::endl; + + // call the EOS to set initial internal energy e + eos(eos_input_rt, state); + + std::cout << "initial eint: " << state.e << std::endl; + + // name of output file + std::ofstream state_over_time("state_over_time.txt"); + + // save the initial state -- we'll use this to determine + // how much things changed over the entire burn + burn_t state_in = state; + + // output the data in columns, one line per timestep + state_over_time << std::setw(10) << "# Time"; + state_over_time << std::setw(15) << "NumberDensity"; + state_over_time << std::setw(15) << "Density"; + state_over_time << std::setw(15) << "Tgas"; + state_over_time << std::setw(15) << "Tdust"; + for (x = 0; x < NumSpec; ++x) { + const std::string &element = short_spec_names_cxx[x]; + state_over_time << std::setw(15) << element; + } + state_over_time << std::endl; + + amrex::Real t = 0.0; + + state_over_time << std::setw(10) << t; + state_over_time << std::setw(15) << sum_numdens; + state_over_time << std::setw(15) << state.rho; + state_over_time << std::setw(15) << state.T; + state_over_time << std::setw(15) << state.aux[0]; + for (x = 0; x < NumSpec; ++x) { + state_over_time << std::setw(15) << state.xn[x]; + } + state_over_time << std::endl; + + // loop over steps, burn, and output the current state + // the loop below is similar to that used in krome and GPUAstroChem + amrex::Real dd = rhotot; + amrex::Real dd1 = 0.0_rt; + + for (n = 0; n < nsteps; n++) { + + dd1 = dd; + + amrex::Real rhotmp = 0.0_rt; + + for (nn = 0; nn < NumSpec; ++nn) { + rhotmp += state.xn[nn] * spmasses[nn]; + } + + // find the freefall time + amrex::Real tff = std::sqrt(M_PI * 3.0 / (32.0 * rhotmp * grav_constant)); + amrex::Real dt = tff_reduc * tff; + // scale the density + dd += dt * (dd / tff); + + // stop the test if dt is very small + if (dt < 10) { + break; + } + + // stop the test if we have reached very high densities + if (dd > 2e-6) { + break; + } + + + // scale the number densities + for (nn = 0; nn < NumSpec; ++nn) { + state.xn[nn] *= dd / dd1; + } + + // update the number density of electrons due to charge conservation + balance_charge(state); + + // input the scaled density in burn state + rhotmp = 0.0_rt; + for (nn = 0; nn < NumSpec; ++nn) { + rhotmp += state.xn[nn] * spmasses[nn]; + } + state.rho = rhotmp; + + // call the EOS to scale internal energy e + eos(eos_input_rt, state); + + //std::cout << "before burn: " << state.rho << ", " << state.T << ", " << state.xn << ", " << state.e << std::endl; + + integrator_rp::ode_max_dt = dt*1e0; + // do the actual integration + burner(state, dt); + + // ensure positivity and normalize + //amrex::Real inmfracs[NumSpec] = {-1.0}; + //amrex::Real insum = 0.0_rt; + //for (int nn = 0; nn < NumSpec; ++nn) { + // state.xn[nn] = amrex::max(state.xn[nn], small_x); + // inmfracs[nn] = spmasses[nn] * state.xn[nn] / state.rho; + // insum += inmfracs[nn]; + //} + + //for (int nn = 0; nn < NumSpec; ++nn) { + // inmfracs[nn] /= insum; + // // update the number densities with conserved mass fractions + // state.xn[nn] = inmfracs[nn] * state.rho / spmasses[nn]; + //} + + // update the number density of electrons due to charge conservation + balance_charge(state); + + // reconserve mass fractions post charge conservation + //insum = 0; + //for (int nn = 0; nn < NumSpec; ++nn) { + // state.xn[nn] = amrex::max(state.xn[nn], small_x); + // inmfracs[nn] = spmasses[nn] * state.xn[nn] / state.rho; + // insum += inmfracs[nn]; + //} + + //for (int nn = 0; nn < NumSpec; ++nn) { + // inmfracs[nn] /= insum; + // // update the number densities with conserved mass fractions + // state.xn[nn] = inmfracs[nn] * state.rho / spmasses[nn]; + //} + + // get the updated T + eos(eos_input_re, state); + + // ensure T is >= TCMB + state.T = amrex::max(state.T, TCMB); + + t += dt; + + // get number density + // make abundance 0 for all metals if metallicity is 0 + sum_numdens = 0.0; + for (nn = 0; nn < NumSpec; ++nn) { + if (metal == 0 && ((nn < 2) || (nn > 15))) { + state.xn[nn] = 0.0; + } + sum_numdens += state.xn[nn]; + } + + state_over_time << std::setw(10) << t; + state_over_time << std::setw(15) << sum_numdens; + state_over_time << std::setw(15) << state.rho; + state_over_time << std::setw(12) << state.T; + state_over_time << std::setw(12) << state.aux[0]; + for (x = 0; x < NumSpec; ++x) { + state_over_time << std::setw(15) << state.xn[x]; + } + state_over_time << std::endl; + std::cout << "step " << n << " done with dt = " << dt << std::endl; + + // print some output at intermediate densities for testing purposes if redshift > 0 + if (state.rho > 1e-18 && state.rho < 1.2e-18 && redshift > 0) { + std::cout << "Tgas = " << state.T << std::endl; + } + + } + state_over_time.close(); + + // output diagnostics to the terminal + std::cout << "------------------------------------" << std::endl; + std::cout << "successful? " << state.success << std::endl; + + std::cout << "------------------------------------" << std::endl; + std::cout << "T initial = " << state_in.T << std::endl; + std::cout << "T final = " << state.T << std::endl; + std::cout << "Tdust initial = " << state_in.aux[0] << std::endl; + std::cout << "Tdust final = " << state.aux[0] << std::endl; + std::cout << "Eint initial = " << state_in.e << std::endl; + std::cout << "Eint final = " << state.e << std::endl; + std::cout << "rho initial = " << state_in.rho << std::endl; + std::cout << "rho final = " << state.rho << std::endl; + std::cout << "numdens final = " << sum_numdens << std::endl; + + std::cout << "------------------------------------" << std::endl; + std::cout << "New number densities: " << std::endl; + for (n = 0; n < NumSpec; ++n) { + std::cout << state.xn[n] << std::endl; + } + + return state.success; +} +#endif diff --git a/unit_test/burn_cell_metal_chem/inputs_metal_chem b/unit_test/burn_cell_metal_chem/inputs_metal_chem new file mode 100644 index 0000000000..c650da3cd4 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/inputs_metal_chem @@ -0,0 +1,90 @@ +unit_test.run_prefix = "burn_cell_metal_chem_" + +# unit_test runtime parameters +unit_test.small_temp = 1.e0 +unit_test.small_dens = 1.e-60 +unit_test.tff_reduc = 1.e-2 +# number of integration steps +unit_test.nsteps = 100000 +# max total time +unit_test.tmax = 7.e20 +# initial temperature +unit_test.temperature = 3e2 +unit_test.ninit = 1e-1 +# initial number densities (will be scaled to metallicity provided below automatically by burn_cell) +unit_test.primary_species_1 = 1e-40 #co_ice +unit_test.primary_species_2 = 1e-40 #h2o_ice +unit_test.primary_species_3 = 1e-4 #e +unit_test.primary_species_4 = 1e-4 #h+ +unit_test.primary_species_5 = 1e0 #h +unit_test.primary_species_6 = 1e-40 #h- +unit_test.primary_species_7 = 1e-40 #d+ +unit_test.primary_species_8 = 1e-5 #d +unit_test.primary_species_9 = 1e-40 #h2+ +unit_test.primary_species_10 = 1e-40 #d- +unit_test.primary_species_11 = 1e-6 #h2 +unit_test.primary_species_12 = 1e-40 #hd+ +unit_test.primary_species_13 = 1e-40 #hd +unit_test.primary_species_14 = 1e-40 #he++ +unit_test.primary_species_15 = 1e-40 #he+ +unit_test.primary_species_16 = 0.0775e0 #he +unit_test.primary_species_17 = 9.27e-5 #c+ +unit_test.primary_species_18 = 1e-40 #c +unit_test.primary_species_19 = 1e-40 #ch +unit_test.primary_species_20 = 1e-40 #ch2 +unit_test.primary_species_21 = 1e-40 #ch3 +unit_test.primary_species_22 = 1e-40 #o+ +unit_test.primary_species_23 = 3.568e-4 #o +unit_test.primary_species_24 = 1e-40 #ch4 +unit_test.primary_species_25 = 1e-40 #oh+ +unit_test.primary_species_26 = 1e-40 #oh +unit_test.primary_species_27 = 1e-40 #h2o+ +unit_test.primary_species_28 = 1e-40 #h2o +unit_test.primary_species_29 = 1e-40 #h3o+ +unit_test.primary_species_30 = 1e-40 #co+ +unit_test.primary_species_31 = 1e-40 #co +unit_test.primary_species_32 = 1e-40 #o2+ +unit_test.primary_species_33 = 1e-40 #o2 +unit_test.primary_species_34 = 1e-40 #co2 + +# integrator runtime parameters +# are we using metal chemistry? then we use number densities +integrator.use_number_densities = 1 +# we do not want to subtract the internal energy +integrator.subtract_internal_energy = 0 +# we do not want to clip species between 0 and 1 +integrator.do_species_clip = 0 +# minimum positive value of number densities +integrator.SMALL_X_SAFE = 1e-60 +integrator.burner_verbose = 0 +# do you want to use the jacobian calculated in a previous step? +integrator.use_jacobian_caching = 1 +# integration will fail if the number density > X_reject_buffer*atol +integrator.X_reject_buffer = 1e100 +# Set which jacobian to use +# 1 = analytic jacobian +# 2 = numerical jacobian +# we do not have an analytic jacobian for this network!! +integrator.jacobian = 2 +# do you want to normalize abundances within VODE? (you don't!) +integrator.renormalize_abundances = 0 +# tolerances +integrator.rtol_spec = 1.0e-4 +integrator.atol_spec = 1.0e-10 +integrator.rtol_enuc = 1.0e-4 +integrator.atol_enuc = 1.0e-10 +#integrator.ode_max_steps = 3000000 + +#assumed redshift for Pop III star formation +network.redshift = 0.0 +network.metallicity = 1 +network.dust2gas_ratio = 1 +network.small_x = 1e-60 + +# amrex runtime parameters +# these params help debug the code +#amrex.throw_exception = 1 +amrex.signal_handling = 0 +#amrex.fpe_trap_invalid = 1 +#amrex.fpe_trap_zerp = 1 +#amrex.fpe_trap_overflow = 1 diff --git a/unit_test/burn_cell_metal_chem/inputs_metal_chem_1 b/unit_test/burn_cell_metal_chem/inputs_metal_chem_1 new file mode 100644 index 0000000000..b121a6efde --- /dev/null +++ b/unit_test/burn_cell_metal_chem/inputs_metal_chem_1 @@ -0,0 +1,88 @@ +unit_test.run_prefix = "burn_cell_metal_chem_" + +# unit_test runtime parameters +unit_test.small_temp = 1.e0 +unit_test.small_dens = 1.e-60 +unit_test.tff_reduc = 1.e-2 +# number of integration steps +unit_test.nsteps = 100000 +# max total time +unit_test.tmax = 7.e20 +# initial temperature +unit_test.temperature = 3e2 +unit_test.ninit = 1e-1 +# initial number densities (will be scaled to metallicity provided below automatically by burn_cell) +unit_test.primary_species_1 = 1e-40 #co_ice +unit_test.primary_species_2 = 1e-40 #h2o_ice +unit_test.primary_species_3 = 1e-4 #e +unit_test.primary_species_4 = 1e-4 #h+ +unit_test.primary_species_5 = 1e0 #h +unit_test.primary_species_6 = 1e-40 #h- +unit_test.primary_species_7 = 1e-40 #d+ +unit_test.primary_species_8 = 1e-5 #d +unit_test.primary_species_9 = 1e-40 #h2+ +unit_test.primary_species_10 = 1e-40 #d- +unit_test.primary_species_11 = 1e-6 #h2 +unit_test.primary_species_12 = 1e-40 #hd+ +unit_test.primary_species_13 = 1e-40 #hd +unit_test.primary_species_14 = 1e-40 #he++ +unit_test.primary_species_15 = 1e-40 #he+ +unit_test.primary_species_16 = 0.0775e0 #he +unit_test.primary_species_17 = 9.27e-5 #c+ +unit_test.primary_species_18 = 1e-40 #c +unit_test.primary_species_19 = 1e-40 #ch +unit_test.primary_species_20 = 1e-40 #ch2 +unit_test.primary_species_21 = 1e-40 #ch3 +unit_test.primary_species_22 = 1e-40 #o+ +unit_test.primary_species_23 = 3.568e-4 #o +unit_test.primary_species_24 = 1e-40 #ch4 +unit_test.primary_species_25 = 1e-40 #oh+ +unit_test.primary_species_26 = 1e-40 #oh +unit_test.primary_species_27 = 1e-40 #h2o+ +unit_test.primary_species_28 = 1e-40 #h2o +unit_test.primary_species_29 = 1e-40 #h3o+ +unit_test.primary_species_30 = 1e-40 #co+ +unit_test.primary_species_31 = 1e-40 #co +unit_test.primary_species_32 = 1e-40 #o2+ +unit_test.primary_species_33 = 1e-40 #o2 +unit_test.primary_species_34 = 1e-40 #co2 + +# integrator runtime parameters +# are we using metal chemistry? then we use number densities +integrator.use_number_densities = 1 +# we do not want to subtract the internal energy +integrator.subtract_internal_energy = 0 +# we do not want to clip species between 0 and 1 +integrator.do_species_clip = 0 +# minimum positive value of number densities +integrator.SMALL_X_SAFE = 1e-60 +integrator.burner_verbose = 0 +# do you want to use the jacobian calculated in a previous step? +integrator.use_jacobian_caching = 1 +# integration will fail if the number density > X_reject_buffer*atol +integrator.X_reject_buffer = 1e100 +# Set which jacobian to use +# 1 = analytic jacobian +# 2 = numerical jacobian +# we do not have an analytic jacobian for this network!! +integrator.jacobian = 2 +# do you want to normalize abundances within VODE? (you don't!) +integrator.renormalize_abundances = 0 +# tolerances +integrator.rtol_spec = 1.0e-4 +integrator.atol_spec = 1.0e-10 +integrator.rtol_enuc = 1.0e-4 +integrator.atol_enuc = 1.0e-10 +#integrator.ode_max_steps = 3000000 + +#assumed redshift for Pop III star formation +network.redshift = 0.0 +network.metallicity = 1 +network.dust2gas_ratio = 1 +network.small_x = 1e-60 + +# amrex runtime parameters +# these params help debug the code +#amrex.throw_exception = 1 +#amrex.signal_handling = 0 +amrex.fpe_trap_invalid=1 diff --git a/unit_test/burn_cell_metal_chem/main.cpp b/unit_test/burn_cell_metal_chem/main.cpp new file mode 100644 index 0000000000..85fc5c412c --- /dev/null +++ b/unit_test/burn_cell_metal_chem/main.cpp @@ -0,0 +1,49 @@ +#include +#include +#include + +#include +#include +using namespace amrex; + +#include +#include +#include +#include +#include + +int main(int argc, char *argv[]) { + + amrex::Initialize(argc, argv); + int success = 0; + + { + // check that correct input file is provided + ParmParse const pp("unit_test"); + std::string const run_prefix = "burn_cell_metal_chem_"; + std::string input_run_prefix; + pp.query("run_prefix", input_run_prefix); + AMREX_ALWAYS_ASSERT_WITH_MESSAGE(run_prefix == input_run_prefix, + "input file is missing or incorrect!"); + + std::cout << "starting the single zone burn..." << std::endl; + + ParmParse ppa("amr"); + + init_unit_test(); + + // C++ EOS initialization (must be done after + // init_extern_parameters) + eos_init(unit_test_rp::small_temp, unit_test_rp::small_dens); + + // C++ Network, RHS, screening, rates initialization + network_init(); + actual_network_init(); + + success = burn_cell_c(); + } + + amrex::Finalize(); + + return (!success); +} diff --git a/unit_test/burn_cell_metal_chem/reference_solution_1.out b/unit_test/burn_cell_metal_chem/reference_solution_1.out new file mode 100644 index 0000000000..f81ada5695 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/reference_solution_1.out @@ -0,0 +1,45 @@ +T final = 2033.7719 +Tdust initial = 2.73 +Tdust final = 2033.610864 +Eint initial = 3.061675486e+10 +Eint final = 1.764013907e+11 +rho initial = 2.203783613e-25 +rho final = 1.969175663e-06 +numdens final = 5.200225029e+17 +------------------------------------ +New number densities: +8.329619835e+13 +2.373088458e+14 +2.040789842 +6.529533105e-08 +1.944958889e+15 +2.554410631e-05 +6.055749336e-13 +9860014349 +1.817920945e-10 +1.199955649e-10 +4.481098213e+17 +2.444960273e-20 +8.975750696e+12 +2.630091902e-09 +8.82330545e-21 +6.963813204e+16 +9.871889761e-21 +6.739096013e-14 +2.597905176e-13 +5.714209204e-11 +1.703374921e-08 +2.53711863e-40 +3.383022442e-15 +1.998329514e-07 +3.16125345e-35 +5.387126028e-11 +1.825600604e-31 +1.766483831e-07 +2.040750381 +1.559962404e-34 +8.563324351e-29 +6.493533745e-05 +2.06061654e-32 +2.973172266e-55 +AMReX (22.07-589-g9b0d63e40412) finalized diff --git a/unit_test/burn_cell_metal_chem/reference_solution_1_z10.out b/unit_test/burn_cell_metal_chem/reference_solution_1_z10.out new file mode 100644 index 0000000000..e485c3b448 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/reference_solution_1_z10.out @@ -0,0 +1,47 @@ +Tgas = 31.53250536 +Tgas = 31.52704064 +T final = 2033.846636 +Tdust initial = 30.03 +Tdust final = 2033.692617 +Eint initial = 3.061675486e+10 +Eint final = 1.764079063e+11 +rho initial = 2.203783613e-25 +rho final = 1.969175663e-06 +numdens final = 5.20022965e+17 +------------------------------------ +New number densities: +8.329620029e+13 +2.373088525e+14 +2.226446088 +0.000297491388 +1.945883073e+15 +2.787567024e-05 +2.759062723e-09 +9864501378 +8.281880969e-07 +1.309455569e-10 +4.481093592e+17 +1.114010181e-16 +8.97571489e+12 +1.601389437e-09 +5.858032102e-21 +6.963813204e+16 +1.415072594e-20 +1.996517884e-16 +7.694480337e-16 +1.691689432e-13 +5.040356928e-11 +5.482635383e-37 +1.604555857e-15 +5.910343021e-10 +1.715097579e-31 +6.415084542e-11 +1.001202566e-27 +2.10230157e-07 +2.226165405 +7.279438235e-38 +3.99809758e-32 +1.023291941e-05 +9.614519081e-36 +1.652332248e-58 +AMReX (22.07-875-gb05f69fe3748) finalized diff --git a/unit_test/burn_cell_metal_chem/reference_solution_1e-1.out b/unit_test/burn_cell_metal_chem/reference_solution_1e-1.out new file mode 100644 index 0000000000..5681bb98d3 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/reference_solution_1e-1.out @@ -0,0 +1,45 @@ +T final = 2580.849045 +Tdust initial = 2.73 +Tdust final = 2580.903736 +Eint initial = 3.074857008e+10 +Eint final = 2.252782311e+11 +rho initial = 2.193512909e-25 +rho final = 1.989589323e-06 +numdens final = 5.416474951e+17 +------------------------------------ +New number densities: +8.412917854e+12 +2.39681895e+13 +2.207979967 +6.56484998e-06 +3.496528463e+16 +0.0001134569489 +5.932464766e-11 +1.640674045e+11 +9.26261325e-09 +4.948497742e-10 +4.363062397e+17 +3.520507679e-18 +8.912257632e+12 +4.109464144e-09 +6.788802573e-22 +7.033451336e+16 +1.460565197e-19 +4.226130576e-11 +2.962304509e-11 +4.321097966e-10 +6.410593413e-09 +2.847622487e-35 +3.523568564e-12 +4.116188787e-09 +1.579040656e-30 +2.800477243e-08 +2.517542637e-28 +2.481297579e-06 +2.208086624 +1.820442242e-35 +2.493711987e-27 +2.172346472e-07 +1.03303842e-33 +1.308968162e-52 +AMReX (22.07-589-g9b0d63e40412) finalized diff --git a/unit_test/burn_cell_metal_chem/reference_solution_1e-2.out b/unit_test/burn_cell_metal_chem/reference_solution_1e-2.out new file mode 100644 index 0000000000..e6a2063eeb --- /dev/null +++ b/unit_test/burn_cell_metal_chem/reference_solution_1e-2.out @@ -0,0 +1,45 @@ +T final = 2811.207219 +Tdust initial = 2.73 +Tdust final = 2811.228114 +Eint initial = 3.076181952e+10 +Eint final = 2.478723199e+11 +rho initial = 2.192485838e-25 +rho final = 1.989661731e-06 +numdens final = 5.670189018e+17 +------------------------------------ +New number densities: +8.412914755e+11 +2.396807474e+12 +2.236235976 +6.405982886e-05 +8.572287708e+16 +0.0001611585155 +5.332298561e-10 +4.037425745e+11 +6.855532471e-08 +7.073005674e-10 +4.109491978e+17 +3.761054318e-17 +8.671678263e+12 +1.456049659e-10 +1.650308794e-21 +7.033451336e+16 +2.473602851e-09 +0.000502828669 +0.000195826651 +0.001167253794 +0.006497881953 +1.865521147e-32 +2.352999816e-10 +0.001602637809 +5.537533357e-28 +9.719529679e-07 +2.822461066e-26 +2.69412668e-05 +2.131195609 +4.275851205e-23 +2.534923404e-13 +0.1051373945 +1.86318788e-21 +8.869168988e-21 +AMReX (22.07-589-g9b0d63e40412) finalized diff --git a/unit_test/burn_cell_metal_chem/reference_solution_1e-3.out b/unit_test/burn_cell_metal_chem/reference_solution_1e-3.out new file mode 100644 index 0000000000..da53a37acc --- /dev/null +++ b/unit_test/burn_cell_metal_chem/reference_solution_1e-3.out @@ -0,0 +1,45 @@ +T final = 2831.090224 +Tdust initial = 2.73 +Tdust final = 2831.289176 +Eint initial = 3.076314515e+10 +Eint final = 2.499224717e+11 +rho initial = 2.192383131e-25 +rho final = 1.989668738e-06 +numdens final = 5.700271327e+17 +------------------------------------ +New number densities: +8.412915268e+10 +2.396823174e+11 +4.033710506 +6.777594776e-05 +9.174097417e+16 +0.0002983374384 +5.593606493e-10 +4.328369028e+11 +7.097532349e-08 +1.311908161e-09 +4.079422459e+17 +4.006694765e-17 +8.64258412e+12 +2.245209778e-14 +2.215435849e-21 +7.033451336e+16 +1.304995286e-08 +8.203048039e-05 +3.050552029e-05 +0.0001694822058 +0.0008735603933 +5.43479155e-31 +6.483863045e-09 +0.0001998289953 +1.534470988e-26 +2.532177639e-05 +7.160676166e-25 +0.0006407136702 +0.4462317747 +2.224187897e-22 +8.810161969e-12 +3.587709209 +9.496345982e-21 +1.037846593e-34 +AMReX (22.07-589-g9b0d63e40412) finalized diff --git a/unit_test/burn_cell_metal_chem/reference_solution_1e-4.out b/unit_test/burn_cell_metal_chem/reference_solution_1e-4.out new file mode 100644 index 0000000000..02948a3460 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/reference_solution_1e-4.out @@ -0,0 +1,45 @@ +T final = 2884.322233 +Tdust initial = 2.73 +Tdust final = 2885.222529 +Eint initial = 3.076327772e+10 +Eint final = 2.555031196e+11 +rho initial = 2.19237286e-25 +rho final = 1.989670334e-06 +numdens final = 5.787722231e+17 +------------------------------------ +New number densities: +8412915325 +2.396818542e+10 +5.962439927 +0.0005137258492 +1.092306741e+17 +0.0004716327583 +4.142389741e-09 +5.183837544e+11 +5.083763652e-07 +2.087320476e-09 +3.991979278e+17 +3.093116661e-16 +8.557037312e+12 +4.381451187e-08 +3.7384033e-20 +7.033451336e+16 +1.431469116e-07 +3.125096897e-05 +1.030321161e-05 +4.764610267e-05 +0.000200901188 +1.246503729e-28 +1.967791718e-07 +3.775902673e-05 +3.167115752e-24 +0.000678373265 +1.175791827e-22 +0.01353231898 +0.03355686142 +1.176079223e-22 +5.66867762e-11 +5.928840231 +4.761295975e-21 +1.381019684e-32 +AMReX (22.07-589-g9b0d63e40412) finalized diff --git a/unit_test/burn_cell_metal_chem/reference_solution_1e-5.out b/unit_test/burn_cell_metal_chem/reference_solution_1e-5.out new file mode 100644 index 0000000000..69a2fca455 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/reference_solution_1e-5.out @@ -0,0 +1,45 @@ +T final = 2770.253479 +Tdust initial = 2.73 +Tdust final = 2770.396907 +Eint initial = 3.076329098e+10 +Eint final = 2.437024468e+11 +rho initial = 2.192371833e-25 +rho final = 1.989670057e-06 +numdens final = 5.612534538e+17 +------------------------------------ +New number densities: +199898176.6 +3038212036 +2.259991418 +0.09252421839 +7.419371216e+16 +0.000154168177 +7.834842422e-07 +3.484514097e+11 +0.0001036533126 +6.744074981e-10 +4.167161489e+17 +5.354504797e-14 +8.726969668e+12 +3.849333801e-12 +1.421503406e-18 +7.033451336e+16 +0.00281312011 +21789165.94 +9352664.009 +64650614.55 +423270591.2 +1.537707812e-26 +1.341686703e-07 +122330252.1 +5.051058737e-22 +0.0006197903089 +3.102910261e-20 +0.02081899296 +2.164703811 +4.251138744e-23 +0.00765019574 +1.387355782e-34 +1.697403972e-27 +3.012881382e-24 +AMReX (22.07-589-g9b0d63e40412) finalized diff --git a/unit_test/burn_cell_metal_chem/reference_solution_1e-6.out b/unit_test/burn_cell_metal_chem/reference_solution_1e-6.out new file mode 100644 index 0000000000..372f204db7 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/reference_solution_1e-6.out @@ -0,0 +1,45 @@ +T final = 2812.050392290817 +Tdust initial = 2.73 +Tdust final = 2812.235837368595 +Eint initial = 30763292303.77594 +Eint final = 247958162899.1352 +rho initial = 2.192371730563381e-25 +rho final = 1.989669757431512e-06 +numdens final = 5.671429626664702e+17 +------------------------------------ +New number densities: +6438308.410300142 +317322562.9538858 +2.486641265170912 +2.274499630590923e-09 +8.597266896217706e+16 +0.0001794039501637353 +1.8925886867936e-14 +404944748318.3216 +2.431869387308584e-12 +7.874340701282926e-10 +4.108267045200611e+17 +1.335778922651524e-21 +8670476376287.059 +3.501410855685503e-14 +6.130614268934865e-26 +7.033451336163859e+16 +2.268083235873295e-12 +3948863.726870825 +1534860.916182474 +9121355.520456472 +50610347.48632588 +4.088062980895315e-28 +0.1452240345710818 +12442512.37027289 +1.216206468005654e-23 +601.0948939083418 +6.175692426101071e-22 +16596.84230665624 +2.486820667629221 +2.85628902206954e-26 +32951.98449995967 +1.632493779270958e-29 +1.471009580362413e-15 +1.014011717966889e-11 +AMReX (22.07-589-g9b0d63e40412) finalized diff --git a/unit_test/burn_cell_metal_chem/test.out b/unit_test/burn_cell_metal_chem/test.out new file mode 100644 index 0000000000..7ebd858d35 --- /dev/null +++ b/unit_test/burn_cell_metal_chem/test.out @@ -0,0 +1,461 @@ +AMReX (23.05-10-g1e2154f614e5) initialized +starting the single zone burn... +Maximum Time (s): 7e+20 +State Temperature (K): 100 +Number Density input (E): 0.0001 +Number Density input (Hp): 0.0001 +Number Density input (H): 1 +Number Density input (Hm): 1e-40 +Number Density input (Dp): 1e-40 +Number Density input (D): 1e-40 +Number Density input (H2p): 1e-40 +Number Density input (Dm): 1e-40 +Number Density input (H2): 1e-06 +Number Density input (HDp): 1e-40 +Number Density input (HD): 1e-40 +Number Density input (HEpp): 1e-40 +Number Density input (HEp): 1e-40 +Number Density input (HE): 0.0775 +step 0 done +step 1 done +step 2 done +step 3 done +step 4 done +step 5 done +step 6 done +step 7 done +step 8 done +step 9 done +step 10 done +step 11 done +step 12 done +step 13 done +step 14 done +step 15 done +step 16 done +step 17 done +step 18 done +step 19 done +step 20 done +step 21 done +step 22 done +step 23 done +step 24 done +step 25 done +step 26 done +step 27 done +step 28 done +step 29 done +step 30 done +step 31 done +step 32 done +step 33 done +step 34 done +step 35 done +step 36 done +step 37 done +step 38 done +step 39 done +step 40 done +step 41 done +step 42 done +step 43 done +step 44 done +step 45 done +step 46 done +step 47 done +step 64 done +step 65 done +step 66 done +step 67 done +step 68 done +step 69 done +step 70 done +step 71 done +step 72 done +step 73 done +step 74 done +step 75 done +step 76 done +step 77 done +step 78 done +step 79 done +step 80 done +step 81 done +step 82 done +step 83 done +step 84 done +step 85 done +step 86 done +step 87 done +step 88 done +step 89 done +step 90 done +step 91 done +step 92 done +step 93 done +step 94 done +step 95 done +step 96 done +step 97 done +step 98 done +step 99 done +step 100 done +step 101 done +step 102 done +step 103 done +step 104 done +step 105 done +step 106 done +step 107 done +step 108 done +step 109 done +step 110 done +step 111 done +step 112 done +step 113 done +step 114 done +step 115 done +step 116 done +step 117 done +step 118 done +step 119 done +step 120 done +step 121 done +step 122 done +step 123 done +step 124 done +step 125 done +step 126 done +step 127 done +step 128 done +step 129 done +step 130 done +step 131 done +step 132 done +step 133 done +step 134 done +step 135 done +step 136 done +step 137 done +step 138 done +step 139 done +step 140 done +step 141 done +step 142 done +step 143 done +step 144 done +step 145 done +step 146 done +step 147 done +step 148 done +step 149 done +step 150 done +step 151 done +step 152 done +step 153 done +step 154 done +step 155 done +step 156 done +step 157 done +step 158 done +step 159 done +step 160 done +step 161 done +step 162 done +step 163 done +step 164 done +step 165 done +step 166 done +step 167 done +step 168 done +step 169 done +step 170 done +step 171 done +step 172 done +step 173 done +step 174 done +step 175 done +step 176 done +step 177 done +step 178 done +step 179 done +step 180 done +step 181 done +step 182 done +step 183 done +step 184 done +step 185 done +step 186 done +step 187 done +step 188 done +step 189 done +step 190 done +step 191 done +step 192 done +step 193 done +step 194 done +step 195 done +step 196 done +step 197 done +step 198 done +step 199 done +step 200 done +step 201 done +step 202 done +step 203 done +step 204 done +step 205 done +step 206 done +step 207 done +step 208 done +step 209 done +step 210 done +step 211 done +step 212 done +step 213 done +step 214 done +step 215 done +step 216 done +step 217 done +step 218 done +step 219 done +step 220 done +step 221 done +step 222 done +step 223 done +step 224 done +step 225 done +step 226 done +step 227 done +step 228 done +step 229 done +step 230 done +step 231 done +step 232 done +step 233 done +step 234 done +step 235 done +step 236 done +step 237 done +step 238 done +step 239 done +step 240 done +step 241 done +step 242 done +step 243 done +step 244 done +step 245 done +step 246 done +step 247 done +step 248 done +step 249 done +step 250 done +step 251 done +step 252 done +step 253 done +step 254 done +step 255 done +step 256 done +step 257 done +step 258 done +step 259 done +step 260 done +step 261 done +step 262 done +step 263 done +step 264 done +step 265 done +step 266 done +step 267 done +step 268 done +step 269 done +step 270 done +step 271 done +step 272 done +step 273 done +step 274 done +step 275 done +step 276 done +step 277 done +step 278 done +step 279 done +step 280 done +step 281 done +step 282 done +step 283 done +step 284 done +step 285 done +step 286 done +step 287 done +step 288 done +step 289 done +step 290 done +step 291 done +step 292 done +step 293 done +step 294 done +step 295 done +step 296 done +step 297 done +step 298 done +step 299 done +step 300 done +step 301 done +step 302 done +step 303 done +step 304 done +step 305 done +step 306 done +step 307 done +step 308 done +step 309 done +step 310 done +step 311 done +step 312 done +step 313 done +step 314 done +step 315 done +step 316 done +step 317 done +step 318 done +step 319 done +step 320 done +step 321 done +step 322 done +step 323 done +step 324 done +step 325 done +step 326 done +step 327 done +step 328 done +step 329 done +step 330 done +step 331 done +step 332 done +step 333 done +step 334 done +step 335 done +step 336 done +step 337 done +step 338 done +step 339 done +step 340 done +step 341 done +step 342 done +step 343 done +step 344 done +step 345 done +step 346 done +step 347 done +step 348 done +step 349 done +step 350 done +step 351 done +step 352 done +step 353 done +step 354 done +step 355 done +step 356 done +step 357 done +step 358 done +step 359 done +step 360 done +step 361 done +step 362 done +step 363 done +step 364 done +step 365 done +step 366 done +step 367 done +step 368 done +step 369 done +step 370 done +step 371 done +step 372 done +step 373 done +step 374 done +step 375 done +step 376 done +step 377 done +step 378 done +step 379 done +step 380 done +step 381 done +step 382 done +step 383 done +step 384 done +step 385 done +step 386 done +step 387 done +step 388 done +step 389 done +step 390 done +step 391 done +step 392 done +step 393 done +step 394 done +step 395 done +step 396 done +step 397 done +step 398 done +step 399 done +step 400 done +step 401 done +step 402 done +step 403 done +step 404 done +step 405 done +step 406 done +step 407 done +step 408 done +step 409 done +step 410 done +step 411 done +step 412 done +step 413 done +step 414 done +step 415 done +step 416 done +step 417 done +step 418 done +step 419 done +step 420 done +step 421 done +step 422 done +step 423 done +step 424 done +step 425 done +step 426 done +step 427 done +step 428 done +step 429 done +step 430 done +step 431 done +step 432 done +------------------------------------ +successful? 1 +------------------------------------ +T initial = 100 +T final = 3032.996043 +Eint initial = 1.025450408e+10 +Eint final = 2.721844122e+11 +rho initial = 2.192338259e-24 +rho final = 1.836285633e-06 +------------------------------------ +New number densities: +19927.94758 +19905.40886 +1.61922269e+17 +1.781134345 +1e-100 +1.44999796 +16.18037372 +1.48979141e-17 +3.378777297e+17 +1e-100 +13.87559962 +2.615599603e-60 +6.366378203e-12 +6.491340305e+16 +AMReX (23.05-10-g1e2154f614e5) finalized diff --git a/unit_test/burn_cell_primordial_chem/burn_cell.H b/unit_test/burn_cell_primordial_chem/burn_cell.H index f878546823..794601d35b 100644 --- a/unit_test/burn_cell_primordial_chem/burn_cell.H +++ b/unit_test/burn_cell_primordial_chem/burn_cell.H @@ -8,6 +8,7 @@ #include #include #include +#include amrex::Real grav_constant = 6.674e-8; @@ -209,8 +210,7 @@ auto burn_cell_c() -> int { } // update the number density of electrons due to charge conservation - state.xn[0] = -state.xn[3] - state.xn[7] + state.xn[1] + state.xn[12] + - state.xn[6] + state.xn[4] + state.xn[9] + 2.0 * state.xn[11]; + balance_charge(state); // reconserve mass fractions post charge conservation insum = 0; diff --git a/util/hybrj/hybrj.H.hack b/util/hybrj/hybrj.H.hack deleted file mode 100644 index f367e4385b..0000000000 --- a/util/hybrj/hybrj.H.hack +++ /dev/null @@ -1,402 +0,0 @@ -#ifndef HYBRJ_H -#define HYBRJ_H - -#include - -#include -#include -#include -#include -#include -#include - -template -void hybrj(hybrj_t& hj, - std::function&, - amrex::Array1D&, - int&)> fcn, - std::function&, - amrex::Array2D&, - int&)> jcn) { - - // the purpose of hybrj is to find a zero of a system of - // n nonlinear functions in n variables by a modification - // of the powell hybrid method. the user must provide a - // subroutine which calculates the functions and the jacobian. - // - // fcn jcn are the names of the user-supplied subroutine which - // calculates the functions and the jacobian. - // - // void fcn(Array1D& x, Array1D& fvec, int& iflag) - // void jcn(Array1D& x, Array2D fjac, int& iflag) - // - // the value of iflag should not be changed by fcn unless - // the user wants to terminate execution of hybrj. - // in this case set iflag to a negative integer. - - bool finished = false; - - Real epsmch = std::numeric_limits::epsilon(); - - hj.info = 0; - int iflag = 0; - hj.nfev = 0; - hj.njev = 0; - - // check the input parameters for errors. - - if (hj.xtol < 0.0_rt) { - amrex::Error("error: xtol must be > 0"); - } - - if (hj.mode == 2) { - for (int j = 1; j <= neqs; ++j) { - if (hj.diag(j) <= 0.0_rt) { - finished = true; - break; - } - } - } - - // evaluate the function at the starting point - // and calculate its norm. - Real fnorm; - - iflag = 1; - - fcn(hj.x, hj.fvec, iflag); - hj.nfev = 1; - if (iflag < 0) { - // user requested abort - finished = true; - } else { - fnorm = enorm(neqs, hj.fvec); - } - - std::cout << "fnorm = " << fnorm << std::endl; - - // initialize iteration counter and monitors. - - int iter = 1; - int ncsuc = 0; - int ncfail = 0; - int nslow1 = 0; - int nslow2 = 0; - - // beginning of the outer loop. - - while (! finished) { - - bool jeval = true; - - // calculate the jacobian matrix. - - jcn(hj.x, hj.fjac, iflag); - hj.njev++; - if (iflag < 0) { - finished = true; - break; - } - - // compute the qr factorization of the jacobian. - - qrfac(hj.fjac, hj.wa1, hj.wa2, hj.wa3); - - for (int i = 1; i <= neqs; ++i) { - for (int j = 1; j <= neqs; ++j) { - std::cout << i << " " << j << " " << hj.fjac(i,j) << std::endl; - } - } - - for (int j = 1; j <= neqs; ++j) { - std::cout << hj.wa1(j) << " " << hj.wa2(j) << " " << hj.wa3(j) << std::endl; - } - - // on the first iteration and if mode is 1, scale according - // to the norms of the columns of the initial jacobian. - - Real delta; - Real xnorm; - - if (iter == 1) { - if (hj.mode != 2) { - for (int j = 1; j <= hj.n; ++j) { - hj.diag(j) = hj.wa2(j); - if (hj.wa2(j) == 0.0_rt) { - hj.diag(j) = 1.0_rt; - } - } - } - - // on the first iteration, calculate the norm of the scaled x - // and initialize the step bound delta. - - for (int j = 1; j <= neqs; ++j) { - hj.wa3(j) = hj.diag(j) * hj.x(j); - } - xnorm = enorm(hj.n, hj.wa3); - delta = factor * xnorm; - if (delta == 0.0_rt) { - delta = factor; - } - } - - // form (q transpose)*fvec and store in qtf. - - for (int i = 1; i <= hj.n; ++i) { - hj.qtf(i) = hj.fvec(i); - } - for (int j = 1; j <= neqs; ++j) { - if (hj.fjac(j,j) != 0.0_rt) { - Real sum = 0.0_rt; - for (int i = j; i <= hj.n; ++i) { - sum += hj.fjac(i,j) * hj.qtf(i); - } - Real temp = -sum / hj.fjac(j,j); - for (int i = j; i <= hj.n; ++i) { - hj.qtf(i) += hj.fjac(i,j) * temp; - } - } - } - - // copy the triangular factor of the qr factorization into r. - - bool sing = false; - - for (int j = 1; j <= hj.n; ++j) { - int l = j; - int jm1 = j - 1; - if (jm1 >= 1) { - for (int i = 1; i <= jm1; ++i) { - hj.r(l) = hj.fjac(i,j); - l = l + neqs - i; - } - } - hj.r(l) = hj.wa1(j); - if (hj.wa1(j) == 0.0_rt) { - sing = true; - } - } - - // accumulate the orthogonal factor in fjac. - - qform(hj.fjac, hj.wa1); - - for (int i = 1; i <= neqs; ++i) { - for (int j = 1; j <= neqs; ++j) { - std::cout << i << " " << j << " " << hj.fjac(i,j) << std::endl; - } - } - - for (int j = 1; j <= neqs; ++j) { - std::cout << hj.wa1(j) << std::endl; - } - - std::cout << " " << std::endl; - - // rescale if necessary. - - if (hj.mode != 2) { - for (int j = 1; j <= hj.n; ++j) { - hj.diag(j) = amrex::max(hj.diag(j), hj.wa2(j)); - } - } - - // beginning of the inner loop. - - while (true) { - - // determine the direction p. - - dogleg(hj.r, hj.diag, hj.qtf, delta, hj.wa1, hj.wa2, hj.wa3); - - std::cout << "dogleg" << std::endl; - for (int j = 1; j <= neqs; ++j) { - std::cout << hj.wa1(j) << std::endl; - } - - // store the direction p and x + p. calculate the norm of p. - - for (int j = 1; j <= neqs; ++j) { - hj.wa1(j) = -hj.wa1(j); - hj.wa2(j) = hj.x(j) + hj.wa1(j); - hj.wa3(j) = hj.diag(j) * hj.wa1(j); - } - - Real pnorm = enorm(hj.n, hj.wa3); - - // on the first iteration, adjust the initial step bound. - - if (iter == 1) { - delta = amrex::min(delta, pnorm); - } - - // evaluate the function at x + p and calculate its norm. - - fcn(hj.wa2, hj.wa4, iflag); - hj.nfev++; - - if (iflag < 0) { - finished = true; - break; - } - - Real fnorm1 = enorm(hj.n, hj.wa4); - - // compute the scaled actual reduction. - - Real actred = -1.0_rt; - if (fnorm1 < fnorm) { - actred = 1.0_rt - std::pow(fnorm1/fnorm, 2.0_rt); - } - - // compute the scaled predicted reduction. - - int l = 1; - for (int i = 1; i <= hj.n; ++i) { - Real sum = 0.0_rt; - for (int j = i; j <= neqs; ++j) { - sum += hj.r(l) * hj.wa1(j); - l += 1; - } - hj.wa3(i) = hj.qtf(i) + sum; - } - Real temp = enorm(hj.n, hj.wa3); - Real prered = 0.0_rt; - if (temp < fnorm) { - prered = 1.0_rt - std::pow(temp/fnorm, 2.0_rt); - } - - // compute the ratio of the actual to the predicted - // reduction. - - Real ratio = 0.0_rt; - if (prered > 0.0_rt) { - ratio = actred / prered; - } - - // update the step bound. - - if (ratio < 0.1_rt) { - ncsuc = 0; - ncfail += 1; - delta = 0.5_rt * delta; - } else { - ncfail = 0; - ncsuc += 1; - if (ratio >= 0.5_rt || ncsuc > 1) { - delta = amrex::max(delta, pnorm / 0.5_rt); - } - if (std::abs(ratio-1.0_rt) <= 0.1_rt) { - delta = pnorm / 0.5_rt; - } - } - - // test for successful iteration. - - if (ratio >= 1.e-4_rt) { - - // successful iteration. update x, fvec, and their norms. - - for (int j = 1; j <= hj.n; ++j) { - hj.x(j) = hj.wa2(j); - hj.wa2(j) = hj.diag(j) * hj.x(j); - hj.fvec(j) = hj.wa4(j); - } - - xnorm = enorm(hj.n, hj.wa2); - fnorm = fnorm1; - iter++; - } - - // determine the progress of the iteration. - - nslow1++; - if (actred >= 1.e-3_rt) { - nslow1 = 0; - } - if (jeval) { - nslow2++; - } - if (actred >= 0.1_rt) { - nslow2 = 0; - } - - // test for convergence. - - if (delta <= hj.xtol * xnorm || fnorm == 0.0_rt) { - hj.info = 1; - } - if (hj.info != 0) { - finished = true; - break; - } - - // tests for termination and stringent tolerances. - - if (hj.nfev >= maxfev) { - hj.info = 2; - } - if (0.1_rt * amrex::max(0.1_rt*delta, pnorm) <= epsmch * xnorm) { - hj.info = 3; - } - if (nslow2 == 5) { - hj.info = 4; - } - if (nslow1 == 10) { - hj.info = 5; - } - if (hj.info != 0) { - finished = true; - break; - } - - // criterion for recalculating jacobian. - - if (ncfail == 2) { - break; - } - - // calculate the rank one modification to the jacobian - // and update qtf if necessary. - - for (int j = 1; j <= hj.n; ++j) { - Real sum = 0.0_rt; - for (int i = 1; i <= hj.n; ++i) { - sum += hj.fjac(i,j) * hj.wa4(i); - } - hj.wa2(j) = (sum - hj.wa3(j)) / pnorm; - hj.wa1(j) = hj.diag(j) * ((hj.diag(j) * hj.wa1(j)) / pnorm); - if (ratio >= 1.e-4_rt) { - hj.qtf(j) = sum; - } - } - - // compute the qr factorization of the updated jacobian. - - r1updt(hj.r, hj.wa1, hj.wa2, hj.wa3, sing); - r1mpyq(hj.fjac, hj.wa2, hj.wa3); - r1mpyq(hj.qtf, hj.wa2, hj.wa3); - - // end of the inner loop. - - jeval = false; - } - - // end of the outer loop - - if (finished) { - break; - } - } - - - // termination, either normal or user imposed. - - if (iflag < 0) { - hj.info = iflag; - } - iflag = 0; - -} -#endif