.gitignore
GaussianUtility_Logo.png
LICENSE
README.md
pyproject.toml
setup.py
gaussianutility/__init__.py
gaussianutility/com2vasp.py
gaussianutility/com2xyz.py
gaussianutility/freezeLayer.py
gaussianutility/gibbsTemp.py
gaussianutility/out2com.py
gaussianutility/printE.py
gaussianutility/sortInput.py
gaussianutility/spectrum.py
gaussianutility/utilities.py
gaussianutility/vasp2com.py
gaussianutility/xyz2com.py
gaussianutility.egg-info/PKG-INFO
gaussianutility.egg-info/SOURCES.txt
gaussianutility.egg-info/dependency_links.txt
gaussianutility.egg-info/entry_points.txt
gaussianutility.egg-info/requires.txt
gaussianutility.egg-info/top_level.txt
test/com2vasp_ZSM5.com
test/com2xyz_EtOH.com
test/freezeLayer_FAU_oniom3.com
test/gibbsTemp_SiAl_trigonal_prism.out
test/out2com_Ru13X_oniom3.out
test/printE_aluminosilicate.out
test/sortInput_FAU_oniom3.com
test/spectrum_ir_Urate1.out
test/spectrum_ir_Urate2.out
test/spectrum_uv_Theophylline1.out
test/spectrum_uv_Theophylline2.out
test/vasp2com_ZSM5.vasp
test/xyz2com_EtOH.xyz