CAPABILITY OF PSEUDOPOTENTIAL METHODS TO SIMULATE ALL-ELECTRON CALCULATIONS WITH FLOATING SPHERICAL GAUSSIAN ORBITALS

被引:13
|
作者
BARTHELAT, JC [1 ]
DURAND, P [1 ]
机构
[1] UNIV TOULOUSE 3,LAB PHYS QUANTIQUE,F-31077 TOULOUSE,FRANCE
关键词
D O I
10.1016/0009-2614(76)85107-X
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
引用
收藏
页码:407 / 409
页数:3
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