scholarly journals A modified repulsive bridge correction to accurate evaluation of solvation free energy in integral equation theory for molecular liquids

2012 ◽  
Vol 137 (2) ◽  
pp. 024106 ◽  
Author(s):  
Kentaro Kido ◽  
Daisuke Yokogawa ◽  
Hirofumi Sato
Keyword(s):  
Integral Equation ◽  
Free Energy ◽  
Solvation Free Energy ◽  
Integral Equation Theory ◽  
Molecular Liquids ◽  
Accurate Evaluation

Dissipative Particle Dynamics with an Effective Pair Potential from Integral Equation Theory of Molecular Liquids

2014 ◽  
Vol 118 (41) ◽  
pp. 12034-12049 ◽  
Author(s):  
Alexander E. Kobryn ◽  
Dragan Nikolić ◽  
Olga Lyubimova ◽  
Sergey Gusarov ◽  
Andriy Kovalenko
Keyword(s):  
Integral Equation ◽  
Dissipative Particle Dynamics ◽  
Pair Potential ◽  
Particle Dynamics ◽  
Integral Equation Theory ◽  
Molecular Liquids ◽  
Effective Pair Potential ◽  
Effective Pair
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