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ELECTRONIC STRUCTURE OF THE TRANSITION METAL ATOMS AS STUDIED BY MANY-BODY PERTURBATION THEORY
Wang Liang-sheng
CHINESE JOURNAL OF COMPUTATIONAL PHYSICS
1986, 3 (1):
14-22.
Many-body perturbation theory is employed in a study of the electronic structure of the transition metal atoms through second-onder in the energy. The basis sets consist of STO[8s6p4d1f]. The agreement with experiment is good for Cr atom.
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