NEAR-MOLECULAR HARTREE-FOCK WAVEFUNCTION FOR CH3+

被引:31
作者
KARI, RE
CSIZMADIA, IG
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D O I
10.1063/1.1840940
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:1817 / +
页数:1
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共 11 条
[1]   NON-EMPIRICAL LCAO-MO-SCF-CI CALCULATIONS ON ORGANIC MOLECULES WITH GAUSSIAN TYPE FUNCTIONS .I. INTRODUCTORY REVIEW AND MATHEMATICAL FORMALISM [J].
CSIZMADI.IG ;
HARRISON, MC ;
MOSKOWIT.JW ;
SUTCLIFF.BT .
THEORETICA CHIMICA ACTA, 1966, 6 (03) :191-&
[2]   LCAO-MO-SCF CALCULATIONS ON LIH USING GAUSSIAN BASIS SET [J].
CSIZMADIA, IG .
JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (05) :1849-+
[3]  
CSIZMADIA IG, 36 POL SYST TECHN NO
[4]  
CSIZMADIA IG, 40 POL SYST TECHN NO
[5]  
DAUDEL R, 1959, QUANTUM CHEMISTRY, P474
[6]   GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I. [J].
HUZINAGA, S .
JOURNAL OF CHEMICAL PHYSICS, 1965, 42 (04) :1293-&
[7]  
JOSHI BD, PRIVATE COMMUNICATIO
[8]  
LYKOS PG, 1964, B AM PHYS SOC, V9, P145
[9]   GEOMETRY OF MOLECULES .I. WAVEFUNCTIONS FOR SOME SIX-AND EIGHT-ELECTRON POLYHYDRIDES [J].
PEYERIMHOFF, SD ;
BUENKER, RJ ;
ALLEN, LC .
JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (02) :734-+