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https://github.com/pfloos/quack
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QuAcK is a small quantum chemistry package written in Fortran. It is mostly used for easy prototyping.
examples | ||
include | ||
input | ||
src | ||
utils | ||
GoDuck | ||
GoInt | ||
GoSph | ||
PyDuck | ||
PyOptions.json | ||
PyOptions.template.json | ||
README.md |
quack
quack is a small quantum chemistry package which does some weird stuff. In particular, quack can performed various types of GW calculations (G0W0, evGW, qsGW, etc). quack also include a very slow integral package called IntPak which does compute many types of different integrals.