.gitignore
.pre-commit-config.yaml
.readthedocs.yaml
CHANGELOG.rst
LICENSE
README.md
pyproject.toml
requirements.txt
setup.py
.github/workflows/build_and_test.yml
.github/workflows/linting.yml
.github/workflows/pip_install_test.yml
.github/workflows/releasing.yml
docs/Makefile
docs/PyTASER.png
docs/make.bat
docs/requirements.txt
docs/source/changelog_link.rst
docs/source/conf.py
docs/source/contributing.rst
docs/source/contributors.rst
docs/source/dft_examples.nblink
docs/source/genindex.rst
docs/source/index.rst
docs/source/license.rst
docs/source/mp_example.nblink
docs/source/pytaser.rst
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examples/PyTASER_DFT_Example.ipynb
examples/PyTASER_MP_Example.ipynb
examples/CdTe/k666_Optics/WAVEDER
examples/CdTe/k666_Optics/vasprun.xml
examples/CdTe/k888_Optics/WAVEDER
examples/CdTe/k888_Optics/vasprun.xml
examples/GaAs/conc_xydata.json
examples/GaAs/gaas_conc_22.json
examples/GaAs/tas_2534.json
examples/GaAs/temp_xydata.json
examples/TiO2/vasprun.xml
examples/TiO2/band/band.pdf
examples/TiO2/band/split-01/KPOINTS
examples/TiO2/band/split-01/vasprun.xml
examples/TiO2/band/split-02/KPOINTS
examples/TiO2/band/split-02/vasprun.xml
examples/TiO2/band/split-03/KPOINTS
examples/TiO2/band/split-03/vasprun.xml
examples/TiO2/band/split-04/KPOINTS
examples/TiO2/band/split-04/vasprun.xml
examples/TiO2/dostest/101015/vasprun.xml
examples/TiO2/dostest/121218/vasprun.xml
examples/TiO2/dostest/669/dos.pdf
examples/TiO2/dostest/669/vasprun.xml
pytaser/__init__.py
pytaser/generator.py
pytaser/kpoints.py
pytaser/plotter.py
pytaser/tas.py
pytaser.egg-info/PKG-INFO
pytaser.egg-info/SOURCES.txt
pytaser.egg-info/dependency_links.txt
pytaser.egg-info/requires.txt
pytaser.egg-info/top_level.txt
tests/__init__.py
tests/conftest.py
tests/test_generator.py
tests/test_plotter.py
tests/data_cdte/cdte_444_bs.json
tests/data_cdte/cdte_444_dos.json
tests/data_cdte/cdte_444_kweights.json
tests/data_cdte/cdte_k666_sumo_absorption.dat
tests/data_cdte/error_testing/CdTe_LVEL_False_WAVEDER
tests/data_cdte/error_testing/CdTe_LVEL_False_vasprun.xml
tests/data_cdte/error_testing/CdTe_symmetry_on_WAVEDER
tests/data_cdte/error_testing/CdTe_symmetry_on_vasprun.xml
tests/data_cdte/remote_baseline_plots/alpha_cdte.png
tests/data_cdte/remote_baseline_plots/jdos_cdte.png
tests/data_cdte/remote_baseline_plots/jdos_diff_cdte.png
tests/data_cdte/remote_baseline_plots/jdos_ev_cdte.png
tests/data_cdte/remote_baseline_plots/jdos_ev_gaas.png
tests/data_cdte/remote_baseline_plots/jdos_lambda_cdte.png
tests/data_cdte/remote_baseline_plots/jdos_lambda_gaas.png
tests/data_cdte/remote_baseline_plots/tas_absorption_only_cdte.png
tests/data_cdte/remote_baseline_plots/tas_cdte.png
tests/data_cdte/remote_baseline_plots/tas_cdte_custom_legend.png
tests/data_cdte/remote_baseline_plots/tas_cdte_scissor_bandgap_3eV.png
tests/data_cdte/remote_baseline_plots/tas_ev_cdte.png
tests/data_cdte/remote_baseline_plots/tas_ev_gaas.png
tests/data_cdte/remote_baseline_plots/tas_lambda_cdte.png
tests/data_cdte/remote_baseline_plots/tas_lambda_gaas.png
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tests/data_gaas/new_gaas_2534_dos.json
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tests/data_gaas/remote_baseline_plots/jdos_cdte.png
tests/data_gaas/remote_baseline_plots/jdos_diff_cdte.png
tests/data_gaas/remote_baseline_plots/jdos_ev_cdte.png
tests/data_gaas/remote_baseline_plots/jdos_ev_gaas.png
tests/data_gaas/remote_baseline_plots/jdos_lambda_cdte.png
tests/data_gaas/remote_baseline_plots/jdos_lambda_gaas.png
tests/data_gaas/remote_baseline_plots/tas_absorption_only_cdte.png
tests/data_gaas/remote_baseline_plots/tas_cdte.png
tests/data_gaas/remote_baseline_plots/tas_cdte_custom_legend.png
tests/data_gaas/remote_baseline_plots/tas_ev_cdte.png
tests/data_gaas/remote_baseline_plots/tas_ev_gaas.png
tests/data_gaas/remote_baseline_plots/tas_lambda_cdte.png
tests/data_gaas/remote_baseline_plots/tas_lambda_gaas.png