Extensive relativistic calculations on the palladium hydride molecules.
| Autor: | Sjovoll, Merethe, Fagerli, Hilde, Gropen, Odd, Almlof, Jan, Saue, Trond, Olsen, Jeppe, Helgaker, Trygve |
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| Zdroj: | Journal of Chemical Physics; 10/8/1997, Vol. 107 Issue 14, p5496, 6p, 10 Charts |
| Abstrakt: | Studies the lower states of the palladium hydride molecule using different relativistic methods. Importance of relativistic effects for proper description of the molecule; Molecular configuration; Configuration interaction. |
| Databáze: | Complementary Index |
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