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Ab Initio Molecular Dynamics Investigation of CH(4)/CO(2) Adsorption on Calcite: Improving the Enhanced Gas Recovery Process

[Image: see text] Ab initio molecular dynamics simulations of CH(4) and CO(2) on the calcite (104) surface have been carried out for the molecular level analysis of CO(2)-enhanced gas recovery process (EGR). This process takes advantage of the stronger interaction of CO(2) with the reservoir walls c...

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Detalles Bibliográficos
Autores principales: Carchini, Giuliano, Al-Marri, Mohammed J., Hussein, Ibnelwaleed A., Aparicio, Santiago
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2020
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7689883/
https://www.ncbi.nlm.nih.gov/pubmed/33251456
http://dx.doi.org/10.1021/acsomega.0c04694

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