Molecular Simulation Study on Adsorption and Diffusion Behaviors of CO2/N2 in Lignite

Hongqing Zhu; Wei Wang; Yujia Huo; Xin He; Hongru Zhao; Haoran Wang

doi:10.1021/acsomega.0c04352

Molecular Simulation Study on Adsorption and Diffusion Behaviors of CO2/N2 in Lignite

ACS Omega ◽

10.1021/acsomega.0c04352 ◽

2020 ◽

Vol 5 (45) ◽

pp. 29416-29426

Author(s):

Hongqing Zhu ◽

Wei Wang ◽

Yujia Huo ◽

Xin He ◽

Hongru Zhao ◽

...

Keyword(s):

Molecular Simulation ◽

Simulation Study ◽

And Diffusion ◽

Diffusion Behaviors

Download Full-text

Adsorption and Diffusion of Methane and Carbon Dioxide in Amorphous Regions of Cross-Linked Polyethylene: A Molecular Simulation Study

Industrial & Engineering Chemistry Research ◽

10.1021/acs.iecr.9b00690 ◽

2019 ◽

Vol 58 (19) ◽

pp. 8426-8436 ◽

Cited By ~ 9

Author(s):

Yafan Yang ◽

Arun Kumar Narayanan Nair ◽

Shuyu Sun

Keyword(s):

Carbon Dioxide ◽

Molecular Simulation ◽

Simulation Study ◽

And Diffusion

Download Full-text

Molecular Simulation Study of the Adsorption and Diffusion Properties of Terephthalic Acid in Various Metal Organic Frameworks

Journal of Inorganic and Organometallic Polymers and Materials ◽

10.1007/s10904-019-01323-9 ◽

2019 ◽

Vol 30 (5) ◽

pp. 1643-1652 ◽

Cited By ~ 2

Author(s):

Ali Bigdeli ◽

Farhad Khorasheh ◽

Somayeh Tourani ◽

Ahmad Khoshgard ◽

H. Hassani Bidaroni

Keyword(s):

Molecular Simulation ◽

Simulation Study ◽

Terephthalic Acid ◽

Metal Organic Frameworks ◽

Metal Organic ◽

And Diffusion ◽

Diffusion Properties

Download Full-text

A molecular simulation study of cavity size distributions and diffusion in para and meta isomers

Polymer ◽

10.1016/j.polymer.2005.06.122 ◽

2005 ◽

Vol 46 (21) ◽

pp. 9155-9161 ◽

Cited By ~ 54

Author(s):

Xiao-Yan Wang ◽

Pieter J. in 't Veld ◽

Ying Lu ◽

Benny D. Freeman ◽

Isaac C. Sanchez

Keyword(s):

Molecular Simulation ◽

Simulation Study ◽

Size Distributions ◽

Cavity Size ◽

And Diffusion

Download Full-text

Gas transport and diffusion coefficients in a coupling coal system of matrix and nano-fracture: A molecular simulation study

Journal of Natural Gas Science and Engineering ◽

10.1016/j.jngse.2022.104407 ◽

2022 ◽

pp. 104407

Author(s):

Tingting Yin ◽

Dameng Liu ◽

Yidong Cai ◽

Marte Gutierrez

Keyword(s):

Molecular Simulation ◽

Simulation Study ◽

Diffusion Coefficients ◽

Gas Transport ◽

Transport And Diffusion ◽

And Diffusion

Download Full-text

Understanding the Adsorption and Diffusion of Carbon Dioxide in Zeolitic Imidazolate Frameworks: A Molecular Simulation Study

The Journal of Physical Chemistry C ◽

10.1021/jp809373r ◽

2009 ◽

Vol 113 (12) ◽

pp. 5004-5009 ◽

Cited By ~ 98

Author(s):

Dahuan Liu ◽

Chengcheng Zheng ◽

Qingyuan Yang ◽

Chongli Zhong

Keyword(s):

Carbon Dioxide ◽

Molecular Simulation ◽

Simulation Study ◽

Zeolitic Imidazolate Frameworks ◽

And Diffusion

Download Full-text

Molecular Simulation Study of Adsorption and Diffusion on Silicalite for a Benzene/CO2Mixture

Langmuir ◽

10.1021/la052843f ◽

2006 ◽

Vol 22 (7) ◽

pp. 3138-3147 ◽

Cited By ~ 24

Author(s):

Xiaopeng Yue ◽

Xiaoning Yang

Keyword(s):

Molecular Simulation ◽

Simulation Study ◽

And Diffusion

Download Full-text

Adsorption and diffusion of hexane isomers in a series of microporous metal-organic frameworks (MOF): A molecular simulation study

10.1063/5.0001120 ◽

2020 ◽

Author(s):

Viral A. Solanki ◽

Bhaskarjyoti Borah

Keyword(s):

Molecular Simulation ◽

Simulation Study ◽

Metal Organic Frameworks ◽

Metal Organic ◽

And Diffusion

Download Full-text

Sorption and Diffusion of Methane and Carbon Dioxide in Amorphous Poly(alkyl acrylates): A Molecular Simulation Study

The Journal of Physical Chemistry B ◽

10.1021/acs.jpcb.9b11840 ◽

2020 ◽

Vol 124 (7) ◽

pp. 1301-1310 ◽

Cited By ~ 3

Author(s):

Yafan Yang ◽

Arun Kumar Narayanan Nair ◽

Shuyu Sun

Keyword(s):

Carbon Dioxide ◽

Molecular Simulation ◽

Simulation Study ◽

Alkyl Acrylates ◽

And Diffusion

Download Full-text

Molecular simulation study on sorption and diffusion processes in polymeric pervaporation membrane materials

Molecular Simulation ◽

10.1080/08927020500474292 ◽

2006 ◽

Vol 32 (2) ◽

pp. 73-83 ◽

Cited By ~ 8

Author(s):

C. Schepers ◽

D. Hofmann

Keyword(s):

Molecular Simulation ◽

Simulation Study ◽

Diffusion Processes ◽

Membrane Materials ◽

Pervaporation Membrane ◽

And Diffusion

Download Full-text

Molecular Simulation Study of the Adsorption and Diffusion of a Mixture of CO2/CH4 in Activated Carbon: Effect of Textural Properties and Surface Chemistry

Journal of Chemical & Engineering Data ◽

10.1021/acs.jced.6b00554 ◽

2016 ◽

Vol 61 (12) ◽

pp. 4139-4147 ◽

Cited By ~ 20

Author(s):

Shanshan Wang ◽

Linghong Lu ◽

Di Wu ◽

Xiaohua Lu ◽

Wei Cao ◽

...

Keyword(s):

Activated Carbon ◽

Surface Chemistry ◽

Molecular Simulation ◽

Simulation Study ◽

Textural Properties ◽

And Diffusion

Download Full-text