├── LICENSE.txt ├── README.org ├── examples ├── QST2.com └── optimize.com └── xtb-gaussian /LICENSE.txt: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/aspuru-guzik-group/xtb-gaussian/HEAD/LICENSE.txt -------------------------------------------------------------------------------- /README.org: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/aspuru-guzik-group/xtb-gaussian/HEAD/README.org -------------------------------------------------------------------------------- /examples/QST2.com: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/aspuru-guzik-group/xtb-gaussian/HEAD/examples/QST2.com -------------------------------------------------------------------------------- /examples/optimize.com: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/aspuru-guzik-group/xtb-gaussian/HEAD/examples/optimize.com -------------------------------------------------------------------------------- /xtb-gaussian: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/aspuru-guzik-group/xtb-gaussian/HEAD/xtb-gaussian --------------------------------------------------------------------------------