Generalized gradient approximation exchange energy functional with correct asymptotic behavior of the corresponding potential

2015 ◽  
Vol 142 (5) ◽  
pp. 054105 ◽  
Author(s):  
Javier Carmona-Espíndola ◽  
José L. Gázquez ◽  
Alberto Vela ◽  
S. B. Trickey
Keyword(s):  
Asymptotic Behavior ◽  
Energy Functional ◽  
Exchange Energy ◽  
Generalized Gradient ◽  
Generalized Gradient Approximation

Generalized Gradient Approximation Exchange Energy Functional with Near-Best Semilocal Performance

2018 ◽  
Vol 15 (1) ◽  
pp. 303-310 ◽  
Author(s):  
Javier Carmona-Espíndola ◽  
José L. Gázquez ◽  
Alberto Vela ◽  
S. B. Trickey
Keyword(s):  
Energy Functional ◽  
Exchange Energy ◽  
Generalized Gradient ◽  
Generalized Gradient Approximation

Global hybrid exchange energy functional with correct asymptotic behavior of the corresponding potential

2016 ◽  
Vol 135 (5) ◽  
Author(s):  
Javier Carmona-Espíndola ◽  
José L. Gázquez ◽  
Alberto Vela ◽  
S. B. Trickey
Keyword(s):  
Asymptotic Behavior ◽  
Energy Functional ◽  
Exchange Energy

Analysis of the kinetic energy functional in the generalized gradient approximation

2021 ◽  
Vol 154 (8) ◽  
pp. 084107
Author(s):  
Héctor I. Francisco ◽  
Javier Carmona-Espíndola ◽  
José L. Gázquez
Keyword(s):  
Kinetic Energy ◽  
Energy Functional ◽  
Generalized Gradient ◽  
Generalized Gradient Approximation ◽  
Kinetic Energy Functional
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