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https://dspace.ffh.bg.ac.rs/handle/123456789/1378| Title: | Ab initio study of the potential energy surfaces of doublet valence and Rydberg states of FCO | Authors: | Krossner, Th Zülicke, L. Vetter, R. Perić, Miljenko Peyerimhoff, S. D. |
Issue Date: | 1-Jan-1994 | Journal: | The Journal of Chemical Physics | Abstract: | Multireference configuration interaction calculations (MRD-CI) were carried out in order to obtain the bending and stretching potential energy curves of several low-lying electronic states of the fluoroformyl radical FCO. The study of interactions between valence and Rydberg states as well as that of the dissociative behavior is included in the investigation. © 1994 American Institute of Physics. |
URI: | https://dspace.ffh.bg.ac.rs/handle/123456789/1378 | ISSN: | 0021-9606 | DOI: | 10.1063/1.467515 |
| Appears in Collections: | Journal Article |
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