scholarly journals Counterintuitive Coulomb hole around the bond midplane

2010 ◽  
Vol 132 (20) ◽  
pp. 204102 ◽  
Author(s):  
Jian Wang ◽  
Kwang S. Kim ◽  
Evert Jan Baerends
Keyword(s):  
Coulomb Hole

Chemical accuracy from ‘Coulomb hole’ extrapolated molecular quantum-mechanical calculations

2001 ◽  
Vol 567-568 ◽  
pp. 375-384 ◽  
Author(s):  
K.L Bak ◽  
A Halkier ◽  
P Jørgensen ◽  
J Olsen ◽  
T Helgaker ◽  
...  
Keyword(s):  
Quantum Mechanical ◽  
Quantum Mechanical Calculations ◽  
Coulomb Hole

scholarly journals Relation between the Fukui function and the Coulomb hole

2005 ◽  
Vol 117 (5) ◽  
pp. 411-418 ◽  
Author(s):  
P. Senet ◽  
M. Yang
Keyword(s):  
Fukui Function ◽  
Coulomb Hole

Coulomb-Hole-Hartree-Fock functional

1994 ◽  
Vol 52 (4) ◽  
pp. 849-865 ◽  
Author(s):  
E. Clementi ◽  
D. W. M. Hofmann
Keyword(s):  
Hartree Fock ◽  
Coulomb Hole
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