The Electronic Structure of the M Center
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概要
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The electronic structure of the M center for LiF has been investigated by L.C.A.O. approximation, assuming L-shape model by Seitz. In this treatment, we have orthogonalized the wave function of the M electron to the core state of Li ion, and evaluated the three center integrals more accurately than the former paper. The calculated value for the M band absorption is 0.078 compared with the experimental value 0.103 in atomic unit. Some discussions concerning to the approximation and symmetry problem are given.
- 社団法人日本物理学会の論文
- 1959-02-05
著者
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Inui Teturo
Department Of Applied Physics Faculty Of Engineering University Of Tokyo
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MIMURA Hiroshi
Department of Applied Physics, Faculty of Engineering, University of Tokyo
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Mimura Hiroshi
Department Of Applied Physics Faculty Of Engineering University Of Tokyo
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