Dirac (software)
id:
dirac-software-265-7103057
title:
Dirac (software)
text:
Dirac is a relativistic ab initio quantum chemistry program. The full name is Program for Atomic and Molecular Direct Iterative Relativistic All-electron Calculations, in short PAM DIRAC. It is capable of calculating various molecular properties using the Hartree–Fock, MP2, density functional theory, configuration interaction and coupled cluster electronic structure theories. Dirac is one of the most successful general-purpose quantum chemistry packages that provides accurate description of rela
brand slug:
wiki
category slug:
encyclopedia
description:
Ab initio quantum chemistry program
original url:
https://en.wikipedia.org/wiki/Dirac_(software)
date created:
date modified:
2023-08-01T22:48:13Z
main entity:
{"identifier":"Q5280159","url":"https://www.wikidata.org/entity/Q5280159"}
image:
{"content_url":"https://upload.wikimedia.org/wikipedia/commons/2/22/DIRAC-example-Output.png","width":408,"height":648}
fields total:
13
integrity:
15