Quantum chemical study of transition metal chromium-phosphorous binary clusters CrP4+ and CrP8+
2002
The possible geometrical structures and relative stability of transition metal chromium-phosphorous clusters CrP4+ and CrP8+ are explored by means of density functional theory (DFT) quantum chemical a calculations (B3LYP). The most stable geometrical structure of CrP4+ and CrP8+ are obtained. The conclusion may be used to explain the relative laser photodissociation experiment.
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