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mirror of https://github.com/pfloos/quack synced 2024-06-26 15:12:17 +02:00

Merge branch 'master' of github.com:pfloos/quack

This commit is contained in:
Pierre-Francois Loos 2019-03-19 23:03:07 +01:00
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# 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.
# 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.