scholarly journals Density depletion profile and solvation free energy of a colloidal particle in a polymer solution

2001 ◽  
Vol 115 (11) ◽  
pp. 5292-5309 ◽  
Author(s):  
R. Maassen ◽  
E. Eisenriegler ◽  
A. Bringer
Keyword(s):  
Free Energy ◽  
Polymer Solution ◽  
Colloidal Particle ◽  
Solvation Free Energy ◽  
Density Depletion

To the fast calculation of the solvation free energy. Combining expanded ensembles with L2MC

2021 ◽  
Vol 42 (11) ◽  
pp. 787-792
Author(s):  
Alexei Nikitin ◽  
Vladislava Milchevskaya ◽  
Alexander Lyubartsev
Keyword(s):  
Free Energy ◽  
Solvation Free Energy ◽  
Fast Calculation

scholarly journals Application of reference-modified density functional theory: Temperature and pressure dependences of solvation free energy

2017 ◽  
Vol 39 (4) ◽  
pp. 202-217 ◽  
Author(s):  
Tomonari Sumi ◽  
Yutaka Maruyama ◽  
Ayori Mitsutake ◽  
Kenji Mochizuki ◽  
Kenichiro Koga
Keyword(s):  
Density Functional Theory ◽  
Free Energy ◽  
Density Functional ◽  
Solvation Free Energy ◽  
Functional Theory ◽  
Temperature And Pressure

Solvation free energy of the proton in acetonitrile

2021 ◽  
Vol 335 ◽  
pp. 116032
Author(s):  
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Jeanet Conradie
Keyword(s):  
Free Energy ◽  
Solvation Free Energy
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