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First-Principles Calculation of Adsorption of Shale Gas on CaCO(3) (100) Surfaces
BACKGROUND: To demonstrate the adsorption strength of shale gas to calcium carbonate in shale matrix, the adsorption of shale gas on CaCO(3) (100) surfaces was studied using the first-principles method, which is based on the density functional theory (DFT). METHODS: The structures and electronic pro...
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| Publicado no: | J Appl Biomater Funct Mater |
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| Main Authors: | , , , , , , |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
SAGE Publications
2017
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6469267/ https://ncbi.nlm.nih.gov/pubmed/28574100 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.5301/jabfm.5000352 |
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