Adding modules to package

src/nomad_simulations/schema_packages/workflow/__init__.py

@@ -0,0 +1,64 @@
+#
+# Copyright The NOMAD Authors.
+#
+# This file is part of NOMAD.
+# See https://nomad-lab.eu for further info.
+#
+# Licensed under the Apache License, Version 2.0 (the "License");
+# you may not use this file except in compliance with the License.
+# You may obtain a copy of the License at
+#
+#     http://www.apache.org/licenses/LICENSE-2.0
+#
+# Unless required by applicable law or agreed to in writing, software
+# distributed under the License is distributed on an "AS IS" BASIS,
+# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
+# See the License for the specific language governing permissions and
+# limitations under the License.
+#
+
+from .base_workflows import (
+    ParallelSimulation,
+    SerialSimulation,
+    SimulationWorkflow,
+    SimulationWorkflowMethod,
+    SimulationWorkflowResults,
+)
+from .chemical_reaction import (
+    ChemicalReaction,
+    ChemicalReactionMethod,
+    ChemicalReactionResults,
+)
+from .dmft import DFTPlusTBPlusDMFT, DFTPlusTBPlusDMFTMethod, DFTPlusTBPlusDMFTResults
+from .elastic import Elastic, ElasticMethod, ElasticResults
+from .equation_of_state import (
+    EquationOfState,
+    EquationOfStateMethod,
+    EquationOfStateResults,
+)
+from .geometry_optimization import (
+    GeometryOptimization,
+    GeometryOptimizationMethod,
+    GeometryOptimizationResults,
+)
+from .gw import DFTPlusGW, DFTPlusGWMethod, DFTPlusGWResults
+from .max_ent import DMFTPlusMaxEnt, DMFTPlusMaxEntMethod, DMFTPlusMaxEntResults
+from .molecular_dynamics import (
+    MolecularDynamics,
+    MolecularDynamicsMethod,
+    MolecularDynamicsResults,
+)
+from .phonon import Phonon, PhononMethod, PhononResults
+from .photon_polarization import (
+    PhotonPolarization,
+    PhotonPolarizationMethod,
+    PhotonPolarizationResults,
+)
+from .single_point import SinglePoint, SinglePointMethod, SinglePointResults
+from .tb import (
+    FirstPrinciplesPlusTB,
+    FirstPrinciplesPlusTBMethod,
+    FirstPrinciplesPlusTBResults,
+)
+from .thermodynamics import Thermodynamics, ThermodynamicsMethod, ThermodynamicsResults
+from .xs import XS, XSMethod, XSResults