ACCURATE QUANTUM-CHEMISTRY CALCULATIONS O F H-3+

Authors
YANG J LIANG GM TIAN AM GU JD YAN GS TANG AQ LI QS
Citation
J. Yang et al., ACCURATE QUANTUM-CHEMISTRY CALCULATIONS O F H-3+, Huaxue xuebao, 52(6), 1994, pp. 562-566
Citations number
17
Categorie Soggetti
Chemistry
Journal title
Huaxue xuebao → ACNP
ISSN journal
05677351
Volume
52
Issue
6
Year of publication
1994
Pages
562 - 566
Database
ISI
SICI code
0567-7351(1994)52:6<562:AQCOFH>2.0.ZU;2-I
Abstract
The second order configuration interaction calculations with a gaussia n basis plus bond functions have been carried out on the ground and th ree excited states of H-3+. The good results show that the bond functi on method can be used as an efficient technique in the accurate comput ation of quantum chemistry.