Cohesive Properties of Alkali Halides and Simple Oxides in the Local-Density Formalism
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概要
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The standard self-consistent KKR band calculations are carried out to fivealkali halides LiF, NaF, LiCl, Nail and KCI, three oxides MgO, Ca0 and BeOand a stulfide CaS within the limit of the local density approximation. The equi-librium lattice constant, the total energy, the bulk modulus and the pressure-volume relation are evaluated by the knowledge of the one-electron energy andthe wave functions at several lattice parameters.
- 社団法人日本物理学会の論文
- 1983-10-15
著者
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Asano Setsuro
Institute For Solid State Physics The University Of Tokyo
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Asano Setsuro
Institute Of Physics College Of General Education University Of Tokyo
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Yamashita Jiro
Department Of Parasitology Faculty Of Veterinary Medicine Hokkaido University
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Yamashita Jiro
Department Of Physics Faculty Of Humanities And Scienses Nihon University
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