SEMIEMPIRICAL EXTENDED HARTREE-FOCK LCAO-MO-METHOD FOR MOLECULES

被引:23
作者
MARTINO, F
LADIK, J
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D O I
10.1063/1.1673295
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:2262 / &
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共 12 条
[1]   QUANTUM THEORY OF CONJUGATED SYSTEMS [J].
DEWAR, MJS .
REVIEWS OF MODERN PHYSICS, 1963, 35 (03) :586-&
[2]   A SEMIEMPIRICAL METHOD FOR CALCULATION OF EXCITED STATES OF MOLECULES [J].
LADIK, J .
ACTA PHYSICA ACADEMIAE SCIENTIARUM HUNGARICAE, 1967, 23 (03) :317-&
[3]   BAND THEORY, VALENCE BOND, AND TIGHT-BINDING CALCULATIONS [J].
LOWDIN, PO .
JOURNAL OF APPLIED PHYSICS, 1962, 33 (01) :251-+
[4]  
Mataga N., 1957, Z PHYS CHEM, V13, P140, DOI [10.1524/zpch.1957.13.3_4.140, DOI 10.1524/ZPCH.1957.13.3_4.140]
[5]  
OHNO K, UNPUBLISHED RESULT
[6]  
PACKER J, UNPUBLISHED RESULTS
[7]   A SEMI-EMPIRICAL THEORY OF THE ELECTRONIC SPECTRA AND ELECTRONIC STRUCTURE OF COMPLEX UNSATURATED MOLECULES .1. [J].
PARISER, R ;
PARR, RG .
JOURNAL OF CHEMICAL PHYSICS, 1953, 21 (03) :466-471
[8]  
PARISER R, 1953, J CHEM PHYS, V21, P707
[9]  
PAUNCZ R, 1967, ALTERNANT MOLECULAR
[10]  
PAUNCZ R, 1967, ALTERNANT MOLECULAR, P33