LICENSE
MANIFEST.in
README.md
__nanoversion__.txt
pyproject.toml
setup.cfg
setup.py
./phono3py/__init__.py
./phono3py/api_isotope.py
./phono3py/api_jointdos.py
./phono3py/api_phono3py.py
./phono3py/file_IO.py
./phono3py/version.py
./phono3py/conductivity/__init__.py
./phono3py/conductivity/base.py
./phono3py/conductivity/direct_solution.py
./phono3py/conductivity/kubo.py
./phono3py/conductivity/rta.py
./phono3py/conductivity/utils.py
./phono3py/conductivity/wigner.py
./phono3py/cui/__init__.py
./phono3py/cui/create_force_constants.py
./phono3py/cui/create_supercells.py
./phono3py/cui/kaccum_script.py
./phono3py/cui/load.py
./phono3py/cui/phono3py_argparse.py
./phono3py/cui/phono3py_script.py
./phono3py/cui/settings.py
./phono3py/cui/show_log.py
./phono3py/cui/triplets_info.py
./phono3py/interface/__init__.py
./phono3py/interface/alm.py
./phono3py/interface/calculator.py
./phono3py/interface/fc_calculator.py
./phono3py/interface/phono3py_yaml.py
./phono3py/other/__init__.py
./phono3py/other/isotope.py
./phono3py/other/kaccum.py
./phono3py/other/tetrahedron_method.py
./phono3py/phonon/__init__.py
./phono3py/phonon/func.py
./phono3py/phonon/grid.py
./phono3py/phonon/group_velocity_matrix.py
./phono3py/phonon/heat_capacity_matrix.py
./phono3py/phonon/solver.py
./phono3py/phonon/velocity_operator.py
./phono3py/phonon3/__init__.py
./phono3py/phonon3/collision_matrix.py
./phono3py/phonon3/dataset.py
./phono3py/phonon3/displacement_fc3.py
./phono3py/phonon3/fc3.py
./phono3py/phonon3/gruneisen.py
./phono3py/phonon3/imag_self_energy.py
./phono3py/phonon3/interaction.py
./phono3py/phonon3/joint_dos.py
./phono3py/phonon3/real_self_energy.py
./phono3py/phonon3/real_to_reciprocal.py
./phono3py/phonon3/reciprocal_to_normal.py
./phono3py/phonon3/spectral_function.py
./phono3py/phonon3/triplets.py
./phono3py/sscha/__init__.py
./phono3py/sscha/sscha.py
c/_phono3py.c
c/_phononcalc.c
c/bzgrid.c
c/bzgrid.h
c/collision_matrix.c
c/collision_matrix.h
c/dynmat.c
c/dynmat.h
c/fc3.c
c/fc3.h
c/grgrid.c
c/grgrid.h
c/gridsys.c
c/gridsys.h
c/imag_self_energy_with_g.c
c/imag_self_energy_with_g.h
c/interaction.c
c/interaction.h
c/isotope.c
c/isotope.h
c/lagrid.c
c/lagrid.h
c/lapack_wrapper.c
c/lapack_wrapper.h
c/niggli.c
c/niggli.h
c/phono3py.c
c/phono3py.h
c/phonoc_array.h
c/phonoc_const.h
c/phonoc_utils.c
c/phonoc_utils.h
c/phonon.c
c/phonon.h
c/phononcalc.c
c/phononcalc.h
c/pp_collision.c
c/pp_collision.h
c/real_self_energy.c
c/real_self_energy.h
c/real_to_reciprocal.c
c/real_to_reciprocal.h
c/reciprocal_to_normal.c
c/reciprocal_to_normal.h
c/snf3x3.c
c/snf3x3.h
c/tetrahedron_method.c
c/tetrahedron_method.h
c/triplet.c
c/triplet.h
c/triplet_grid.c
c/triplet_grid.h
c/triplet_iw.c
c/triplet_iw.h
example/AlN-LDA/BORN
example/AlN-LDA/FORCES_FC2
example/AlN-LDA/FORCES_FC3.lzma
example/AlN-LDA/POSCAR-unitcell
example/AlN-LDA/README.md
example/AlN-LDA/phono3py_disp.yaml
example/AlN-LDA/phono3py_disp_dimfc2.yaml
example/NaCl-alm/README.md
example/NaCl-alm/phono3py_params_NaCl222.yaml.xz
example/Si-CRYSTAL/FORCES_FC2
example/Si-CRYSTAL/FORCES_FC3
example/Si-CRYSTAL/README
example/Si-CRYSTAL/TEMPLATE
example/Si-CRYSTAL/TEMPLATE3
example/Si-CRYSTAL/crystal.o
example/Si-CRYSTAL/outputs.tar.gz
example/Si-LDA/FORCES_FC3
example/Si-LDA/POSCAR-unitcell
example/Si-LDA/README.md
example/Si-LDA/phono3py_disp.yaml
example/Si-LDA/vasprun_xmls.tar.lzma
example/Si-PBE/FORCES_FC3
example/Si-PBE/POSCAR-unitcell
example/Si-PBE/README.md
example/Si-PBE/phono3py_disp.yaml
example/Si-PBE/vasprun_xmls.tar.lzma
example/Si-PBEsol/FORCES_FC3
example/Si-PBEsol/POSCAR-unitcell
example/Si-PBEsol/README.md
example/Si-PBEsol/Si-band-DOS.png
example/Si-PBEsol/Si-kaccum.png
example/Si-PBEsol/Si.py
example/Si-PBEsol/phono3py_disp.yaml
example/Si-PBEsol/phono3py_disp_dimfc2.yaml
example/Si-PBEsol/vasprun_xmls.tar.lzma
example/Si-PBEsol/vasprun_xml_fc2/disp-fc2-00001/INCAR
example/Si-PBEsol/vasprun_xml_fc2/disp-fc2-00001/POSCAR
example/Si-PBEsol/vasprun_xml_fc2/disp-fc2-00001/vasprun.xml
example/Si-QE/FORCES_FC3
example/Si-QE/README.md
example/Si-QE/Si.in
example/Si-QE/disp_fc3.yaml
example/Si-QE/phono3py_disp.yaml
example/Si-QE/supercell_out.tar.lzma
example/Si-TURBOMOLE/FORCES_FC2
example/Si-TURBOMOLE/FORCES_FC3
example/Si-TURBOMOLE/README
example/Si-TURBOMOLE/control
example/Si-TURBOMOLE/coord
example/Si-TURBOMOLE/outputs.tar.gz
example/Wigner_La2Zr2O7/BORN
example/Wigner_La2Zr2O7/POSCAR
example/Wigner_La2Zr2O7/command.sh
example/Wigner_La2Zr2O7/fc2.hdf5
example/Wigner_La2Zr2O7/kappa-m191919.hdf5
example/Wigner_La2Zr2O7/tc_La2Zr2O7.out.xz
example/zb-ZnTe-PBEsol/README.md
example/zb-ZnTe-PBEsol/launch_phono3py_ZnTe_PBEsol_222.py
example/zb-ZnTe-PBEsol/phono3py_params_ZnTe.yaml.xz
phono3py.egg-info/PKG-INFO
phono3py.egg-info/SOURCES.txt
phono3py.egg-info/dependency_links.txt
phono3py.egg-info/requires.txt
phono3py.egg-info/top_level.txt
scripts/phono3py
scripts/phono3py-coleigplot
scripts/phono3py-kaccum
scripts/phono3py-kdeplot
scripts/phono3py-load
test/AgNO2_cell.yaml
test/BORN_NaCl
test/FORCES_FC3_si_pbesol
test/FORCE_SETS_NaCl
test/conftest.py
test/phono3py_params-Si111-rd.yaml.xz
test/phono3py_params_AlN332.yaml.xz
test/phono3py_params_NaCl111.yaml
test/phono3py_params_NaCl222.yaml.xz
test/phono3py_params_Si-111-222.yaml
test/phono3py_params_Si111.yaml
test/phono3py_si_pbesol.yaml
test/phonopy_disp_NaCl.yaml
test/phonopy_params-Si111-iterha.yaml.gz
test/phonopy_params_Si.yaml
test/api/test_api_phono3py.py
test/conductivity/__init__.py
test/conductivity/test_kappa_LBTE.py
test/conductivity/test_kappa_LBTE_Wigner.py
test/conductivity/test_kappa_RTA.py
test/conductivity/test_kappa_RTA_Wigner.py
test/cui/test_phono3py_load_script.py
test/interface/test_phono3py_yaml.py
test/other/__init__.py
test/other/test_isotope.py
test/other/test_kaccum.py
test/phonon/__init__.py
test/phonon/test_grid.py
test/phonon/test_velocity_operator.py
test/phonon3/__init__.py
test/phonon3/test_displacements.py
test/phonon3/test_fc3.py
test/phonon3/test_imag_self_energy.py
test/phonon3/test_interaction.py
test/phonon3/test_joint_dos.py
test/phonon3/test_real_self_energy.py
test/phonon3/test_spectral_function.py
test/phonon3/test_triplets.py
test/sscha/__init__.py
test/sscha/test_sscha.py