RELATIONSHIPS AMONG DERIVATIVES OF THE INTEGRALS IN THE CALCULATION OF THE GRADIENT OF THE ELECTRONIC-ENERGY WITH RESPECT TO THE NUCLEAR COORDINATES

被引:22
作者
KAHN, LR
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关键词
D O I
10.1063/1.442553
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 ;
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页码:3962 / 3966
页数:5
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