LCPQ
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quack
mirror of https://github.com/pfloos/quack
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Antoine Marie 3941db73e3 fix conflict, nuclear energy fixed in previous commit 2 months ago
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int bug in ufGW and ufG0W0 2 months ago
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GoHu debugging BSE@GT 2 years ago
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README.md README 2 years ago

README.md

QuAcK

QuAcK is a small quantum chemistry package which does some weird stuff.

In particular, quack can perform

  1. various types of GW calculations (G0W0, evGW, qsGW, etc).

  2. ensemble DFT calculations (under progress)

QuAcK also includes a very slow integral package called IntPak which does compute many types of different integrals.