CLUSTER EXPANSION OF WAVEFUNCTION - SYMMETRY-ADAPTED-CLUSTER EXPANSION, ITS VARIATIONAL DETERMINATION, AND EXTENSION OF OPEN-SHELL ORBITAL THEORY

被引:635
作者
NAKATSUJI, H [1 ]
HIRAO, K [1 ]
机构
[1] SHIGA UNIV MED SCI,DEPT CHEM,OTSU,JAPAN
关键词
D O I
10.1063/1.436028
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
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页码:2053 / 2065
页数:13
相关论文
共 65 条
[61]  
TUAN DF, 1963, J CHEM PHYS, V38, P1740
[62]   THEORY OF ATOMIC STRUCTURE INCLUDING ELECTRON CORRELATION .3. CALCULATIONS OF MULTIPLET OSCILLATOR STRENGTHS AND COMPARISONS WITH EXPERIMENTS FOR C2, NI, N2, N3, O2, O3, O4, F2, NE2, AND NA3 [J].
WESTHAUS, P ;
SINANOGLU, O .
PHYSICAL REVIEW, 1969, 183 (01) :56-+
[63]   EQUATIONS OF MOTION APPROACH FOR OPEN-SHELL SYSTEMS [J].
YEAGER, DL ;
MCKOY, V .
JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (11) :4861-4869
[64]  
Yek J., 1969, INT J QUANTUM CHEM, V3, P149
[65]  
1969, ADV CHEM PHYS, V14