phono3py 3.1.2__tar.gz → 3.2.0__tar.gz
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- {phono3py-3.1.2/phono3py.egg-info → phono3py-3.2.0}/PKG-INFO +2 -2
- {phono3py-3.1.2 → phono3py-3.2.0}/README.md +19 -19
- phono3py-3.2.0/__nanoversion__.txt +1 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/api_phono3py.py +440 -175
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/conductivity/base.py +21 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/conductivity/direct_solution.py +5 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/conductivity/rta.py +2 -2
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/conductivity/utils.py +6 -7
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/create_force_constants.py +180 -67
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/create_supercells.py +10 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/load.py +116 -136
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/phono3py_argparse.py +40 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/phono3py_script.py +17 -4
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/settings.py +18 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/show_log.py +3 -2
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/file_IO.py +18 -10
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/interface/calculator.py +0 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/interface/fc_calculator.py +28 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/interface/phono3py_yaml.py +7 -6
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon/grid.py +1 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/displacement_fc3.py +6 -8
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/fc3.py +29 -29
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/gruneisen.py +2 -4
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/imag_self_energy.py +6 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/interaction.py +18 -3
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/joint_dos.py +19 -12
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/real_self_energy.py +15 -15
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/spectral_function.py +2 -2
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/triplets.py +4 -3
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/version.py +1 -1
- {phono3py-3.1.2 → phono3py-3.2.0/phono3py.egg-info}/PKG-INFO +2 -2
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py.egg-info/SOURCES.txt +1 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py.egg-info/requires.txt +1 -1
- phono3py-3.2.0/pyproject.toml +19 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/scripts/phono3py-coleigplot +9 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/scripts/phono3py-kdeplot +6 -7
- {phono3py-3.1.2 → phono3py-3.2.0}/setup.py +3 -3
- {phono3py-3.1.2 → phono3py-3.2.0}/test/api/test_api_phono3py.py +40 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/conductivity/test_kappa_RTA.py +0 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/test/conductivity/test_kappa_RTA_Wigner.py +0 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/test/conftest.py +11 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/test/cui/test_phono3py_load_script.py +1 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/other/test_kaccum.py +1 -0
- phono3py-3.2.0/test/phono3py_params_MgO-222rd-444rd.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/sscha/test_sscha.py +0 -5
- phono3py-3.1.2/__nanoversion__.txt +0 -1
- phono3py-3.1.2/pyproject.toml +0 -14
- {phono3py-3.1.2 → phono3py-3.2.0}/LICENSE +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/MANIFEST.in +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/_phono3py.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/_phononcalc.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/bzgrid.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/bzgrid.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/collision_matrix.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/collision_matrix.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/dynmat.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/dynmat.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/fc3.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/fc3.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/grgrid.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/grgrid.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/gridsys.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/gridsys.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/imag_self_energy_with_g.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/imag_self_energy_with_g.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/interaction.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/interaction.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/isotope.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/isotope.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/lagrid.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/lagrid.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/lapack_wrapper.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/lapack_wrapper.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/niggli.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/niggli.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phono3py.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phono3py.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phonoc_array.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phonoc_const.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phonoc_utils.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phonoc_utils.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phonon.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phonon.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phononcalc.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/phononcalc.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/pp_collision.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/pp_collision.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/real_self_energy.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/real_self_energy.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/real_to_reciprocal.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/real_to_reciprocal.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/reciprocal_to_normal.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/reciprocal_to_normal.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/snf3x3.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/snf3x3.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/tetrahedron_method.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/tetrahedron_method.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/triplet.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/triplet.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/triplet_grid.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/triplet_grid.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/triplet_iw.c +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/c/triplet_iw.h +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/AlN-LDA/BORN +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/AlN-LDA/FORCES_FC2 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/AlN-LDA/FORCES_FC3.lzma +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/AlN-LDA/POSCAR-unitcell +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/AlN-LDA/README.md +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/AlN-LDA/phono3py_disp.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/AlN-LDA/phono3py_disp_dimfc2.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/NaCl-alm/README.md +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/NaCl-alm/phono3py_params_NaCl222.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-CRYSTAL/FORCES_FC2 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-CRYSTAL/FORCES_FC3 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-CRYSTAL/README +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-CRYSTAL/TEMPLATE +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-CRYSTAL/TEMPLATE3 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-CRYSTAL/crystal.o +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-CRYSTAL/outputs.tar.gz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-LDA/FORCES_FC3 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-LDA/POSCAR-unitcell +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-LDA/README.md +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-LDA/phono3py_disp.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-LDA/vasprun_xmls.tar.lzma +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBE/FORCES_FC3 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBE/POSCAR-unitcell +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBE/README.md +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBE/phono3py_disp.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBE/vasprun_xmls.tar.lzma +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/FORCES_FC3 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/POSCAR-unitcell +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/README.md +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/Si-band-DOS.png +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/Si-kaccum.png +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/Si.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/phono3py_disp.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/phono3py_disp_dimfc2.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/vasprun_xml_fc2/disp-fc2-00001/INCAR +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/vasprun_xml_fc2/disp-fc2-00001/POSCAR +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/vasprun_xml_fc2/disp-fc2-00001/vasprun.xml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-PBEsol/vasprun_xmls.tar.lzma +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-QE/FORCES_FC3 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-QE/README.md +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-QE/Si.in +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-QE/phono3py_disp.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-QE/supercell_out.tar.lzma +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-TURBOMOLE/FORCES_FC2 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-TURBOMOLE/FORCES_FC3 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-TURBOMOLE/README +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-TURBOMOLE/control +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-TURBOMOLE/coord +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Si-TURBOMOLE/outputs.tar.gz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Wigner_La2Zr2O7/BORN +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Wigner_La2Zr2O7/POSCAR +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Wigner_La2Zr2O7/command.sh +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Wigner_La2Zr2O7/fc2.hdf5 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Wigner_La2Zr2O7/kappa-m191919.hdf5 +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/Wigner_La2Zr2O7/tc_La2Zr2O7.out.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/zb-ZnTe-PBEsol/README.md +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/zb-ZnTe-PBEsol/launch_phono3py_ZnTe_PBEsol_222.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/example/zb-ZnTe-PBEsol/phono3py_params_ZnTe.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/api_isotope.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/api_jointdos.py +1 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/conductivity/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/conductivity/kubo.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/conductivity/wigner.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/create_force_sets.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/kaccum_script.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/cui/triplets_info.py +1 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/interface/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/interface/alm.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/other/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/other/isotope.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/other/kaccum.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/other/tetrahedron_method.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon/func.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon/group_velocity_matrix.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon/heat_capacity_matrix.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon/solver.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon/velocity_operator.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/collision_matrix.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/dataset.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/real_to_reciprocal.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/phonon3/reciprocal_to_normal.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/sscha/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py/sscha/sscha.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py.egg-info/dependency_links.txt +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/phono3py.egg-info/top_level.txt +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/scripts/phono3py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/scripts/phono3py-kaccum +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/scripts/phono3py-load +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/setup.cfg +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/AgNO2_cell.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/BORN_NaCl +0 -0
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- {phono3py-3.1.2 → phono3py-3.2.0}/test/Si-111-222-fd.tar.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/Si-111-222-rd.tar.xz +0 -0
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- {phono3py-3.1.2 → phono3py-3.2.0}/test/conductivity/test_kappa_LBTE.py +0 -0
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- {phono3py-3.1.2 → phono3py-3.2.0}/test/cui/phono3py_params-qe-Si222.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/file_IO/test_file_IO.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/interface/test_phono3py_yaml.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/other/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/other/test_isotope.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_params-Si111-rd.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_params_AlN332.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_params_NaCl111.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_params_NaCl222.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_params_Si-111-222-fd.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_params_Si-111-222-rd.yaml.xz +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_params_Si-111-222.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_params_Si111.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phono3py_si_pbesol.yaml +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon/test_grid.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon/test_velocity_operator.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/__init__.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/test_displacements.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/test_fc3.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/test_imag_self_energy.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/test_interaction.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/test_joint_dos.py +1 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/test_real_self_energy.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/test_spectral_function.py +0 -0
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonon3/test_triplets.py +1 -1
- {phono3py-3.1.2 → phono3py-3.2.0}/test/phonopy_disp_NaCl.yaml +0 -0
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Name: phono3py
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Summary: This is the phono3py module.
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Home-page: http://phonopy.github.io/phono3py/
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Author: Atsushi Togo
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# phono3py
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A simulation package of phonon-phonon interaction related properties
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A simulation package of phonon-phonon interaction related properties mainly
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## Mailing list for questions
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## Dependency
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