This script is for Slackware 13.0 and may be outdated.

SlackBuilds Repository

13.0 > Academic > mpqc (2.3.1)

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 libraries.
Unoptimized versions can be found at, atlas or
CPU vendor supported libraries can be used instead to achieve
optimal perfomance.

Maintained by: Daniil Bratashov
Approved by: rworkman
Keywords: mpqc,ab-initio,dft,Massively Parallel Quantum Chemistry Program,ghemical,mp2,opt2,zapt2


Source Downloads:
mpqc-2.3.1.tar.bz2 (2f9b4f7487387730d78066a53764f848)

Download SlackBuild:
mpqc.tar.gz.asc (FAQ)

(the SlackBuild does not include the source)

Validated for Slackware 13.0

See our HOWTO for instructions on how to use the contents of this repository.

Access to the repository is available via:
ftp git cgit http rsync

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