EQUATION FOR DIRECT DETERMINATION OF DENSITY MATRIX

被引:237
作者
NAKATSUJI, H [1 ]
机构
[1] KYOTO UNIV,FAC ENGN,DEPT HYDROCARB CHEM,KYOTO,JAPAN
来源
PHYSICAL REVIEW A | 1976年 / 14卷 / 01期
关键词
D O I
10.1103/PhysRevA.14.41
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
引用
收藏
页码:41 / 50
页数:10
相关论文
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