MATRIX ELEMENTS OF Z/R3 AND (3Z2-R2)/R5 IN A SLATER BASIS FOR LINEAR SYSTEMS

被引:10
作者
MCLEAN, AD
YOSHIMINE, M
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D O I
10.1063/1.1840939
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:1812 / +
页数:1
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[1]  
BARNETT MP, 1963, METHODS COMPUTATIONA, V2, P95
[2]   2-CENTER INTEGRALS OVER SOLID SPHERICAL HARMONICS [J].
GELLER, M .
JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (01) :84-&
[3]   ELECTRONIC STRUCTURE OF CO AND BF [J].
HUO, WM .
JOURNAL OF CHEMICAL PHYSICS, 1965, 43 (02) :624-&
[4]   MAPPING AN ARBITRARY RANGE INTO (-1,1) WITH A SIDE CONDITION - APPLICATION TO NUMERICAL QUADRATURES [J].
MCLEAN, AD ;
YOSHIMIN.M .
IBM JOURNAL OF RESEARCH AND DEVELOPMENT, 1965, 9 (03) :203-&
[5]  
MCLEAN AD, 1966, NJ89 IBM RES NOT
[6]   EVALUATION OF MOLECULAR INTEGRALS BY SOLID SPHERICAL HARMONIC EXPANSIONS [J].
PITZER, RM ;
KERN, CW ;
LIPSCOMB, WN .
JOURNAL OF CHEMICAL PHYSICS, 1962, 37 (02) :267-&
[7]  
ROSE ME, 1957, ELEMENTARY THEORY AN, pCH2
[8]   HYPERFINE INTERACTION AND QUADRUPOLE COUPLING CONSTANT IN THE HYDROGEN MOLECULE ION [J].
STEPHEN, MJ ;
AUFFRAY, JP .
JOURNAL OF CHEMICAL PHYSICS, 1959, 31 (05) :1329-1332