THEORETICAL-STUDY OF THE BONDING IN CUH AND CU2

被引:42
作者
RAGHAVACHARI, K [1 ]
SUNIL, KK [1 ]
JORDAN, KD [1 ]
机构
[1] UNIV PITTSBURGH, DEPT CHEM, PITTSBURGH, PA 15260 USA
关键词
D O I
10.1063/1.449034
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:4633 / 4640
页数:8
相关论文
共 35 条
[1]   MOLECULAR HYPERPOLARIZABILITIES .1. THEORETICAL CALCULATIONS INCLUDING CORRELATION [J].
BARTLETT, RJ ;
PURVIS, GD .
PHYSICAL REVIEW A, 1979, 20 (04) :1313-1322
[2]   MANY-BODY PERTURBATION-THEORY AND COUPLED CLUSTER THEORY FOR ELECTRON CORRELATION IN MOLECULES [J].
BARTLETT, RJ .
ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1981, 32 :359-401
[3]  
BARTLETT RJ, 1978, INT J QUANTUM CHEM, V14, P156
[4]   ON THE NATURE OF THE BONDING IN CU-2 - AN ABINITIO VIEWPOINT [J].
BAUSCHLICHER, CW ;
WALCH, SP ;
SIEGBAHN, PEM .
JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (06) :3347-3348
[6]   ON THE NATURE OF THE BONDING IN CU2 [J].
BAUSCHLICHER, CW ;
WALCH, SP .
JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (12) :6015-6017
[7]  
BINKLEY JS, 1980, QCPE, V8, P406
[8]  
Carsky Petr, 1980, AB INITIO CALCULATIO, P01
[9]   COUPLED CLUSTER APPROACH [J].
CIZEK, J ;
PALDUS, J .
PHYSICA SCRIPTA, 1980, 21 (3-4) :251-254
[10]  
DAS D, 1981, J CHEM PHYS, V74, P1566