Compton profile of cuprous oxide by linear combination of Gaussian orbitals

被引:5
作者
Deb, A
Chatterjee, AK
机构
[1] Department of Physics, Bose Institute
关键词
D O I
10.1088/0953-8984/8/27/022
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
In this paper we report self-consistent all-electron local-density calculations using the linear combination of Gaussian orbitals method for cuprous oxide. We calculated the directional Compton profile and their anisotropic effect. The spherical average Compton profile has also been calculated and compared with the experimental results. We also calculated the density of states of cuprous oxide.
引用
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页码:5139 / 5148
页数:10
相关论文
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