First derivative of molecular integrals for electronic energy using spherical gaussian type orbitals

1997 ◽  
Vol 389 (1-2) ◽  
pp. 169-177 ◽  
Author(s):  
A.H. Pakiari ◽  
M. Oftadeh
Keyword(s):  
Electronic Energy ◽  
First Derivative ◽  
Gaussian Type ◽  
Molecular Integrals

Molecular integrals in terms of ellipsoidal gaussian-type orbitals

1971 ◽  
Vol 8 (2) ◽  
pp. 201-207 ◽  
Author(s):  
D.B. Cook ◽  
P.Th. van Duijnen
Keyword(s):  
Gaussian Type ◽  
Molecular Integrals

Molecular integrals over Gaussian-type geminal basis functions

1997 ◽  
Vol 97 (1-4) ◽  
pp. 240-250 ◽  
Author(s):  
B. Joakim Persson ◽  
Peter R. Taylor
Keyword(s):  
Basis Functions ◽  
Gaussian Type ◽  
Molecular Integrals
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