Molecular Simulation Study on Factors Affecting Carbon Dioxide Adsorption on Amorphous Silica Surfaces

2020 ◽  
Vol 124 (23) ◽  
pp. 12580-12588
Author(s):  
Ki Chul Kim ◽  
Seung Soon Jang
Keyword(s):  
Carbon Dioxide ◽  
Molecular Simulation ◽  
Simulation Study ◽  
Amorphous Silica ◽  
Carbon Dioxide Adsorption ◽  
Factors Affecting ◽  
Silica Surfaces

Monte Carlo Molecular Simulation Study of Carbon Dioxide Sequestration into Dry and Wet Calcite Pores Containing Methane

2021 ◽  
Author(s):  
Srikanth Ravipati ◽  
Mirella Simoes Santos ◽  
Ioannis G. Economou ◽  
Amparo Galindo ◽  
George Jackson ◽  
...  
Keyword(s):  
Carbon Dioxide ◽  
Monte Carlo ◽  
Molecular Simulation ◽  
Simulation Study ◽  
Carbon Dioxide Sequestration

scholarly journals Water adsorption on amorphous silica surfaces: a Car–Parrinello simulation study

2005 ◽  
Vol 17 (26) ◽  
pp. 4005-4013 ◽  
Author(s):  
Claus Mischler ◽  
Jürgen Horbach ◽  
Walter Kob ◽  
Kurt Binder
Keyword(s):  
Simulation Study ◽  
Amorphous Silica ◽  
Water Adsorption ◽  
Silica Surfaces

Effects of nanoconfinement and surface charge on iron adsorption on mesoporous silica

2021 ◽  
Author(s):  
Jeffery A. Greathouse ◽  
Tyler J. Duncan ◽  
Anastasia G. Ilgen ◽  
Jacob A. Harvey ◽  
Louise J. Criscenti ◽  
...  
Keyword(s):  
Mesoporous Silica ◽  
Surface Charge ◽  
Pore Size ◽  
Molecular Simulation ◽  
Amorphous Silica ◽  
Surface Complexation ◽  
X Ray ◽  
Silica Surfaces

A combination of molecular simulation and X-ray adsorption spectroscopy reveal the effects of pore size and nanoconfinement on the adsorption and surface complexation of aqueous iron at amorphous silica surfaces.

Sign in / Sign up

Export Citation Format

Share Document