mirror of https://github.com/pfloos/quack
Pierre-Francois Loos ff5b9e4e09 | ||
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basis | ||
bin | ||
include | ||
input | ||
int | ||
lib | ||
libxc-tools | ||
mol | ||
numgrid-tools | ||
plot | ||
qcaml-tools | ||
scripts | ||
src | ||
utils | ||
.gitignore | ||
GoDuck | ||
GoInt | ||
GoSph | ||
INSTALL.txt | ||
LICENSE | ||
Makefile | ||
README.md |
README.md
QuAcK
QuAcK is a small quantum chemistry package which does some weird stuff. In particular, quack can performed i) various types of GW calculations (G0W0, evGW, qsGW, etc). ii) ensemble DFT calculations (under progress) QuAcK also include a very slow integral package called IntPak which does compute many types of different integrals.