Massively parallel quantum chemistry
id:
massively-parallel-quantum-chemistry-277-11693714
title:
Massively parallel quantum chemistry
text:
Massively Parallel Quantum Chemistry (MPQC) is an ab initio computational chemistry software program. Three features distinguish it from other quantum chemistry programs such as Gaussian and GAMESS: it is open-source, has an object-oriented design, and is created from the beginning as a parallel processing program. It is available in Ubuntu and Debian. MPQC provides implementations for a number of important methods for calculating electronic structure, including Hartree–Fock, Møller–Plesset pert
brand slug:
wiki
category slug:
encyclopedia
description:
original url:
https://en.wikipedia.org/wiki/Massively_parallel_quantum_chemistry
date created:
date modified:
2023-10-05T03:48:25Z
main entity:
{"identifier":"Q6717323","url":"https://www.wikidata.org/entity/Q6717323"}
image:
fields total:
13
integrity:
13