Semi-empirical approximations for the coulomb and bond integrals in simple LCAO-MO methods

1965 ◽  
Vol 3 (2) ◽  
pp. 147-155 ◽  
Author(s):  
Ricardo Ferreira
Keyword(s):  
Semi Empirical ◽  
Simple Lcao ◽  
Lcao Mo

Errata: 1,2‐ versus 1,4‐Addition to 1,3‐ Butadiene by a Simple LCAO‐MO Method

1959 ◽  
Vol 30 (2) ◽  
pp. 591-591 ◽  
Author(s):  
Frank L. Pilar
Keyword(s):  
Simple Lcao ◽  
Lcao Mo

A Further Study of Simple LCAO MO Perturbation Treatment of Conjugated Molecules

1960 ◽  
Vol 33 (7) ◽  
pp. 963-973 ◽  
Author(s):  
Kenichi Fukui ◽  
Keiji Morokuma ◽  
Teijiro Yonezawa ◽  
Chikayoshi Nagata
Keyword(s):  
Conjugated Molecules ◽  
Simple Lcao ◽  
Lcao Mo

LCAO-MO-SCF-CI semi-empirical ?-electron calculations on heteroaromatic systems

1968 ◽  
Vol 9 (4) ◽  
pp. 288-295 ◽  
Author(s):  
D. R. Forshey ◽  
G. W. Pukanic ◽  
Br. Jerome D. Wegener ◽  
J. B. Greenshields
Keyword(s):  
Semi Empirical ◽  
Lcao Mo

scholarly journals An Interpretation of Mass Spectra of Disubstituted Benzenes by Simple LCAO MO Calculation. I

1971 ◽  
Vol 44 (4) ◽  
pp. 884-887 ◽  
Author(s):  
Susumu Tajima ◽  
Nobuhide Wasada ◽  
Toshikazu Tsuchiya
Keyword(s):  
Mass Spectra ◽  
Mo Calculation ◽  
Simple Lcao ◽  
Lcao Mo

LCAO-MO-SCF-CI semi-empirical ?-electron calculations on heteroaromatic systems

1967 ◽  
Vol 9 (1) ◽  
pp. 38-50 ◽  
Author(s):  
G. W. Pukanic ◽  
D. R. Forshey ◽  
Br. Jerome D. Wegener ◽  
J. B. Greenshields
Keyword(s):  
Semi Empirical ◽  
Lcao Mo

scholarly journals An Interpretation of Mass Spectra by Simple LCAO MO Calculation. II. Derivatives of Benzene and Chlorobenzene

1972 ◽  
Vol 45 (4) ◽  
pp. 1250-1251 ◽  
Author(s):  
Susumu Tajima ◽  
Yoshio Niwa ◽  
Nobuhide Wasada ◽  
Toshikazu Tsuchiya
Keyword(s):  
Mass Spectra ◽  
Mo Calculation ◽  
Derivatives Of ◽  
Simple Lcao ◽  
Lcao Mo

1,2‐ versus 1,4‐Addition to 1,3‐Butadiene by a Simple LCAO‐MO Method

1958 ◽  
Vol 29 (5) ◽  
pp. 1119-1122 ◽  
Author(s):  
Frank L. Pilar
Keyword(s):  
Simple Lcao ◽  
Lcao Mo

scholarly journals On the Parameterization in the Semi-Empirical LCAO MO Method

1965 ◽  
Vol 38 (1) ◽  
pp. 83-85 ◽  
Author(s):  
Takeshi Nakajima
Keyword(s):  
Semi Empirical ◽  
Lcao Mo
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