Improved Solvents for CO2 Capture by Molecular Simulation Methodology

2017 ◽  
pp. 147-160
Author(s):  
William R. Smith ◽  
William R. Smith
Keyword(s):  
Molecular Simulation ◽  
Co2 Capture ◽  
Simulation Methodology

scholarly journals Molecular simulation and experimental investigation of CO2 capture in a polymetallic cation-exchanged 13X zeolite

2018 ◽  
Vol 6 (40) ◽  
pp. 19570-19583 ◽  
Author(s):  
Shujun Chen ◽  
Min Zhu ◽  
Yingchun Tang ◽  
Yue Fu ◽  
Wenliang Li ◽  
...  
Keyword(s):  
Experimental Investigation ◽  
Molecular Simulation ◽  
Co2 Capture ◽  
Flue Gas ◽  
High Performance ◽  
Simulation Approach ◽  
13X Zeolite ◽  
Zeolite P

A molecular simulation approach can guide the design of high-performance LiPdAgX zeolite for CO2 capture from flue gas.

scholarly journals A detailed study of cholinium chloride and levulinic acid deep eutectic solvent system for CO2 capture via experimental and molecular simulation approaches

2015 ◽  
Vol 17 (32) ◽  
pp. 20941-20960 ◽  
Author(s):  
Ruh Ullah ◽  
Mert Atilhan ◽  
Baraa Anaya ◽  
Majeda Khraisheh ◽  
Gregorio García ◽  
...  
Keyword(s):  
Molecular Simulation ◽  
Co2 Capture ◽  
Levulinic Acid ◽  
Choline Chloride ◽  
Deep Eutectic Solvent ◽  
Solvent System ◽  
Suitable Material

Choline chloride + levulinic acid deep eutectic solvent is studied as a suitable material for CO2 capturing purposes.

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