Valence bond programs
id:
valence-bond-programs-176-3815779
title:
Valence bond programs
text:
Valence bond (VB) computer programs for modern valence bond calculations:-
- CRUNCH, by Gordon A. Gallup and his group.
- GAMESS (UK), includes calculation of VB wave functions by the TURTLE code, due to J.H. van Lenthe.
- GAMESS (US), has links to interface VB2000, and XMVB.
- MOLPRO and MOLCAS include code by David L. Cooper for generating Spin Coupled VB wave functions from CASSCF calculations.
- VB2000 version 3.0, by Jiabo Li, Brian Duke, David W. O. de Sousa, Rodrigo S. Bitzer an
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wiki
category slug:
encyclopedia
description:
original url:
https://en.wikipedia.org/wiki/Valence_bond_programs
date created:
2005-11-02T02:54:22Z
date modified:
2024-09-03T12:21:04Z
main entity:
{"identifier":"Q7910631","url":"https://www.wikidata.org/entity/Q7910631"}
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13
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