Determination of Binding Energy and Solubility Parameters for Functionalized Gold Nanoparticles by Molecular Dynamics Simulation

Langmuir ◽  
2011 ◽  
Vol 27 (12) ◽  
pp. 7836-7842 ◽  
Author(s):  
Brian J. Henz ◽  
Peter W. Chung ◽  
Jan W. Andzelm ◽  
Tanya L. Chantawansri ◽  
Joseph L. Lenhart ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Gold Nanoparticles ◽  
Molecular Dynamics Simulation ◽  
Binding Energy ◽  
Dynamics Simulation ◽  
Solubility Parameters ◽  
Functionalized Gold Nanoparticles

Determination of CO2 diffusivity in subsurface systems using molecular dynamics simulation

2020 ◽  
Author(s):  
Oluwaseyi Aliu ◽  
Hamzah Sakidin ◽  
Jalal foroozesh ◽  
Surajudeen Sikiru
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Dynamics Simulation
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