Update changelog for 3.1.1

doc/ChangeLog.md

@@ -2,6 +2,73 @@
 
 # Changelog
 
+## Version 3.1.1
+
+solid_dmft version 3.1.1 is a patch-release that improves / fixes the following issues:
+
+* delete obsolete make_spaghetti.py
+* SOC self energies can be continued in maxent
+* run hubbardI solver on all nodes due to slow bcast performance of atomdiag object
+* fix DFT energy read when running CSC QE
+* updated documentation, small fixes to tutorials
+* exposed params of maxent_gf_imp
+* fix the way dft_mu is loaded in PCB
+* fix executable in SVO tutorial
+* fix shift in sigma continuator to remove dft_mu
+* fix chemical potential in plot Akw and minor fixes
+* correct plotlabels in postprocessing
+* tiny modification of printing H_loc in postprocessing
+
+Contributors: Sophie Beck, Alberto Carta, Max Merkel
+
+## Version 3.1.0
+
+solid_dmft version 3.1.0 is a major release that provides tutorials in the documentation, changes to app4triqs skeleton, allows CSC calculations with QE, improves postprocessing routines, and add functionality for SOC calculations.
+
+* all new tutorials
+* generalize measure_chi functionality
+* CSC with Vasp 6.3.0 works, examples updated
+* fix two bugs in w90 interface in vasp
+* Renamed files
+* fix Fermi level print in mlwf.F LPRJ_WRITE call
+* Automatic patching of vasp 6.3.0 with Docker
+* Updated tutorial
+* Added check on all mpi ranks if dmft_config exists at beginning of run
+* fix small bug in convergence.py thanks @merkelm
+* Rework convergence metrics
+* remove gf_struct_flatten from solver in accordance with latest dfttools version
+* Renaming to solid_dmft
+* Update of maxent_gf_latt.py: more parameters exposed and spin averaging is not default anymore
+* fix bug in afm calculation when measuring density matrix
+* Add w90_tolerance flag for CSC
+* use sphinx autosummary for module reference
+* small changes in IO, additional mpi barriers in csc flow for better stability
+* With SOC now program prints real and imag part of matrices
+* Fixed creation of Kanamori Hamiltonian with SOC
+* Improvements in plot_correlated_bands.py and updated tutorial
+* change output name of MaxEnt Sigma to Sigma_maxent
+* change to develop version of w90 because of mpi bug in openmpi dockerfile
+* bugfix in plot_correlated_bands and cleaning up
+* update OpenMPI Dockerfile to latest Ubuntu
+* Tutorial to explore correlated bands using the postprocessing script
+* check in CSC with QE if optional files are presesnt, otherwise skip calculation
+* Updated maxent_sigma: mpi parallelization, continuator types, bug fixes, parameters exposed
+* update installation instructions
+* add workflow and code structure images
+* Updated maxent sigma script
+* W90 runs in parallel
+* Fixing a bug related to measure_pert_order and measure_chi_SzSz for afm_order
+* add vasp crpa scripts and tutorials
+* add delta interface for cthyb
+* fix get_dmft_bands and pass eta to alatt_k_w correctly
+* allows to recompute rotation matrix even if W90 is used
+* bugfix in initial_self_energies.py in case dc = False
+* flatten gf_struct for triqs solvers to remove depracted warning
+* add example files for SVO and LNO
+* bump triqs and package version to 3.1
+
+Contributors: Sophie Beck, Alberto Carta, Max Merkel
+
 ## Version 3.0.0
 
 solid_dmft version 3.0.0 is a compatibility