๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Variational configuration interaction methods and comparison with perturbation theory

โœ Scribed by J. A. Pople; R. Seeger; R. Krishnan


Publisher
John Wiley and Sons
Year
2009
Tongue
English
Weight
644 KB
Volume
12
Category
Article
ISSN
0020-7608

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


g-Matrix Based on Configuration Interact
โœ Wenjie Li; Maochun Hong; Rong Cao; Beisheng Kang; Hanqin Liu ๐Ÿ“‚ Article ๐Ÿ“… 1999 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 83 KB

Stone's formula, which has usually been applied to the calculation of the g-matrix, is based on a single-configuration treatment. Here a limited configuration interaction is included to obtain the expressions of the principal g values for an orbitally nondegenerate molecule with spin S โ€ซุโ€ฌ 1 2 .

Correlation energy in triplet states com
โœ Petr ฤŒรกrsky; Michal Svrฤek; Ivan Hubaฤ; Franklin B. Brown; Isaiah Shavitt ๐Ÿ“‚ Article ๐Ÿ“… 1982 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 300 KB

Reccwcd 7 Scpwmbcr 1981 hl.my-body Raylc@-Schrodmgcr pcrturbat~on theon m the rcstnctcd MO iormdlsm through thwd order and contiguratron mtcrxllon covc~g alI smgl~ and doubly cwttcd states were apphcd to the lo\hest tnplet ztxes oi the mcthylene and oxygen molecules The corrclat~on cncrpo g\en b) th