scholarly journals Constructing a non-additive non-interacting kinetic energy functional approximation for covalent bonds from exact conditions

2018 ◽  
Vol 149 (16) ◽  
pp. 164112 ◽  
Author(s):  
Kaili Jiang ◽  
Jonathan Nafziger ◽  
Adam Wasserman
Keyword(s):  
Kinetic Energy ◽  
Energy Functional ◽  
Covalent Bonds ◽  
Functional Approximation ◽  
Kinetic Energy Functional

Gradient expansion of the atomic kinetic energy functional

1976 ◽  
Vol 43 (3) ◽  
pp. 409-412 ◽  
Author(s):  
Wen-Ping Wang ◽  
Robert G. Parr ◽  
Danny R. Murphy ◽  
George A. Henderson
Keyword(s):  
Kinetic Energy ◽  
Energy Functional ◽  
Gradient Expansion ◽  
Kinetic Energy Functional
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