|
|||||
|
|
Localized molecular orbitals in CI calculations of organic molecules |
|
| Authors: | Thomas Neuheuser Malte von Arnim Sigrid D. Peyerimhoff |
| Affiliation: | (1) Institut für Physikalische und Theoretische Chemie, Universität Bonn, Wegelerstraße 12, W-5300 Bonn 1, Federal Republic of Germany |
| Abstract: | |
| Keywords: | CI calculations LMO Bond-breaking processes |
| 本文献已被 SpringerLink 等数据库收录！ | |