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https://dspace.ffh.bg.ac.rs/handle/123456789/1435| Title: | Ab initio calculation of vibronic levels in the <sup>2</sup>π<inf>u</inf> state of ph<inf>2</inf> | Authors: | Perić, Miljenko | Issue Date: | 15-Dec-1980 | Journal: | Chemical Physics Letters | Abstract: | The results of an ab initio treatment of the Renner effect in the 2πu state of PH2 are reported The Born-Oppenheimer potential surfaces calculated by means of the MRD CI method are used A variational method, based on polynomial expansions of the molecular potentials and the kinetic-energy operator, is employed for calculation of vibronic levels. © 1980. |
URI: | https://dspace.ffh.bg.ac.rs/handle/123456789/1435 | ISSN: | 0009-2614 | DOI: | 10.1016/0009-2614(80)80671-3 |
| Appears in Collections: | Journal Article |
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