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slackbuilds_ponce/academic/mpqc
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Robby Workman 143991a46e Entire Repo: Remove APPROVED field from .info files 
This field used to make sense in our pre-git days, but
the Signed-Off-By: line serves the same purpose (and
even more) now, so APPROVED has been rejected.  ;-)

Signed-off-by: Robby Workman <rworkman@slackbuilds.org>
2012-08-14 23:22:50 -05:00
..
mpqc-sclibdir_x86_64.patch
mpqc.info Entire Repo: Remove APPROVED field from .info files 2012-08-14 23:22:50 -05:00
mpqc.SlackBuild
README
slack-desc

README 

MPQC is the Massively Parallel Quantum Chemistry Program.
It computes properties of atoms and molecules from first principles
using the time independent Schrödinger equation. Methods supported
are: HF, MP2 AND DFT for energies and gradients, OPT2 and ZAPT2
for energies.

MPQC requires blas and lapack.