This is a Python library that provides for reading and editing Gaussian 16 input and output files.
It also provides error detection and 3D coordinates exportation.
- read_out: Read .out file
- read_in: Read and edit .gjf file
- write_xyz: Generate an XYZ format file from object coord attributes.
- write_in: Write mult-GaussianIn objects as links in a .gjf file.
- GaussianOut: Class for parsing an output file
- GaussianIn: Class for parsing an input file
- Yu Che