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CEPA calculations on open-shell molecules. I. Outline of the method |
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| Authors: | Volker Staemmler Ralph Jaquet |
| Institution: | (1) Lehrstuhl für Theoretische Chemie, Abteilung für Chemie, Ruhr-Universität Bochum, 4630 Bochum 1, Federal Republic of Germany |
| Abstract: | |
| Keywords: | Coupled electron pair approximation (CEPA) Open-shell molecules Pair natural orbitals (PNOs) |
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