ELECTRONIC BAND STRUCTURES OF CU2SB-TYPE INTERMETALLIC COMPOUNDS

被引:27
作者
CHONAN, T
YAMADA, A
MOTIZUKI, K
机构
[1] Department of Material Physics, Faculty of Engineering Science, Osaka University
关键词
ELECTRONIC BAND; CR2AS; CRMNAS; MN2AS; FE2AS; MNFEAS; MN2SB; APW; BOND ORDER;
D O I
10.1143/JPSJ.60.1638
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
Self-consistent APW band calculations are carried out for non-magnetic states of transition-metal intermetallic compounds having Cu2Sb-type crystal structure. The energy dispersions, densities of states and Fermi surfaces are shown. Differences and similarities of the electronic band structures of Cr, Mn, Fe-arsenides are clarified. To discuss the bonding nature, calculations of the bond order are also carried out.
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页码:1638 / 1646
页数:9
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