{"id":"https://openalex.org/W4200375656","doi":"https://doi.org/10.1016/j.molliq.2021.118306","title":"Adsorption and diffusion behavior of CO2/H2 mixture in calcite slit pores: A molecular simulation study","display_name":"Adsorption and diffusion behavior of CO2/H2 mixture in calcite slit pores: A molecular simulation study","publication_year":2021,"publication_date":"2021-12-11","ids":{"openalex":"https://openalex.org/W4200375656","doi":"https://doi.org/10.1016/j.molliq.2021.118306"},"language":"en","primary_location":{"id":"doi:10.1016/j.molliq.2021.118306","doi":"https://doi.org/10.1016/j.molliq.2021.118306","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.molliq.2021.118306","pdf_url":null,"source":{"id":"https://openalex.org/S189140625","display_name":"Journal of Molecular Liquids","issn_l":"0167-7322","issn":["0167-7322","1873-3166"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","jufo-1","ki-jl-1","norway-1","poland-100","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Molecular Liquids","raw_type":"journal-article"},"volume":null,"type":"article","indexed_in":["crossref"],"open_access":{"is_oa":false,"oa_status":"closed","oa_url":null,"any_repository_has_fulltext":false},"authorships":[{"author_position":"first","author":{"id":"https://openalex.org/A5101485125","display_name":"Xinxin Deng","orcid":"https://orcid.org/0000-0002-8949-6385","observed_orcids":["https://orcid.org/0000-0002-8949-6385"]},"institutions":[{"id":"https://openalex.org/I158842170","display_name":"Chongqing University","ror":"https://ror.org/023rhb549","country_code":"CN","type":"education","lineage":["https://openalex.org/I158842170"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Xinxin Deng","raw_affiliation_strings":["Key Laboratory of Low-grade Energy Utilization Technologies and Systems, Ministry of Education, School of Energy and Power Engineering, Chongqing University, Chongqing 400044, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Key Laboratory of Low-grade Energy Utilization Technologies and Systems, Ministry of Education, School of Energy and Power Engineering, Chongqing University, Chongqing 400044, China","institution_ids":["https://openalex.org/I158842170"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5112378573","display_name":"Quanguo Zhang","orcid":null,"observed_orcids":[]},"institutions":[{"id":"https://openalex.org/I4750791","display_name":"Henan Agricultural University","ror":"https://ror.org/04eq83d71","country_code":"CN","type":"education","lineage":["https://openalex.org/I4750791"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Quanguo Zhang","raw_affiliation_strings":["Laboratory of New Materials and Facilities for Rural Renewable Energy of Ministry of Agriculture and Rural Affairs, Henan Agricultural University, Zhengzhou 450002, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of New Materials and Facilities for Rural Renewable Energy of Ministry of Agriculture and Rural Affairs, Henan Agricultural University, Zhengzhou 450002, China","institution_ids":["https://openalex.org/I4750791"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5100389491","display_name":"Zhiping Zhang","orcid":"https://orcid.org/0000-0002-8414-8859","observed_orcids":["https://orcid.org/0000-0002-8414-8859"]},"institutions":[{"id":"https://openalex.org/I4750791","display_name":"Henan Agricultural University","ror":"https://ror.org/04eq83d71","country_code":"CN","type":"education","lineage":["https://openalex.org/I4750791"]}],"countries":["CN"],"is_corresponding":false,"raw_author_name":"Zhiping Zhang","raw_affiliation_strings":["Laboratory of New Materials and Facilities for Rural Renewable Energy of Ministry of Agriculture and Rural Affairs, Henan Agricultural University, Zhengzhou 450002, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Laboratory of New Materials and Facilities for Rural Renewable Energy of Ministry of Agriculture and Rural Affairs, Henan Agricultural University, Zhengzhou 450002, China","institution_ids":["https://openalex.org/I4750791"]}]},{"author_position":"middle","author":{"id":"https://openalex.org/A5072803831","display_name":"Qibin Li","orcid":"https://orcid.org/0000-0001-9365-3788","observed_orcids":["https://orcid.org/0000-0001-9365-3788"]},"institutions":[{"id":"https://openalex.org/I158842170","display_name":"Chongqing University","ror":"https://ror.org/023rhb549","country_code":"CN","type":"education","lineage":["https://openalex.org/I158842170"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Qibin Li","raw_affiliation_strings":["Key Laboratory of Low-grade Energy Utilization Technologies and Systems, Ministry of Education, School of Energy and Power Engineering, Chongqing University, Chongqing 400044, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Key Laboratory of Low-grade Energy Utilization Technologies and Systems, Ministry of Education, School of Energy and Power Engineering, Chongqing University, Chongqing 400044, China","institution_ids":["https://openalex.org/I158842170"]}]},{"author_position":"last","author":{"id":"https://openalex.org/A5100341808","display_name":"Xiangyang Liu","orcid":"https://orcid.org/0000-0002-8636-1610","observed_orcids":["https://orcid.org/0000-0002-8636-1610"]},"institutions":[{"id":"https://openalex.org/I87445476","display_name":"Xi'an Jiaotong University","ror":"https://ror.org/017zhmm22","country_code":"CN","type":"education","lineage":["https://openalex.org/I87445476"]}],"countries":["CN"],"is_corresponding":true,"raw_author_name":"Xiangyang Liu","raw_affiliation_strings":["Key Laboratory of Thermo-Fluid Science and Engineering of MOE, School of Energy and Power Engineering, Xi\u2019an Jiaotong University, Xi'an 710049, China","Key Laboratory of Thermo-Fluid Science and Engineering of MOE, School of Energy and Power Engineering, Xi'an Jiaotong University, Xi'an 710049, China"],"raw_orcid":null,"affiliations":[{"raw_affiliation_string":"Key Laboratory of Thermo-Fluid Science and Engineering of MOE, School of Energy and Power Engineering, Xi\u2019an Jiaotong University, Xi'an 710049, China","institution_ids":["https://openalex.org/I87445476"]},{"raw_affiliation_string":"Key Laboratory of Thermo-Fluid Science and Engineering of MOE, School of Energy and Power Engineering, Xi'an Jiaotong University, Xi'an 710049, China","institution_ids":["https://openalex.org/I87445476"]}]}],"institutions":[],"countries_distinct_count":1,"institutions_distinct_count":3,"corresponding_author_ids":["https://openalex.org/A5072803831","https://openalex.org/A5100341808"],"corresponding_institution_ids":["https://openalex.org/I158842170","https://openalex.org/I87445476"],"apc_list":{"value":3560,"currency":"USD","value_usd":3560},"apc_paid":null,"fwci":2.6453,"has_fulltext":false,"cited_by_count":60,"citation_normalized_percentile":{"value":0.92095469,"is_in_top_1_percent":false,"is_in_top_10_percent":true},"cited_by_percentile_year":{"min":93,"max":100},"biblio":{"volume":"346","issue":null,"first_page":"118306","last_page":"118306"},"is_retracted":false,"is_paratext":false,"is_xpac":false,"primary_topic":{"id":"https://openalex.org/T13604","display_name":"Adsorption, diffusion, and thermodynamic properties of materials","score":0.4496999979019165,"subfield":{"id":"https://openalex.org/subfields/1607","display_name":"Spectroscopy"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},"topics":[{"id":"https://openalex.org/T13604","display_name":"Adsorption, diffusion, and thermodynamic properties of materials","score":0.4496999979019165,"subfield":{"id":"https://openalex.org/subfields/1607","display_name":"Spectroscopy"},"field":{"id":"https://openalex.org/fields/16","display_name":"Chemistry"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T11302","display_name":"CO2 Sequestration and Geologic Interactions","score":0.19689999520778656,"subfield":{"id":"https://openalex.org/subfields/2305","display_name":"Environmental Engineering"},"field":{"id":"https://openalex.org/fields/23","display_name":"Environmental Science"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}},{"id":"https://openalex.org/T10967","display_name":"Carbon Dioxide Capture Technologies","score":0.10369999706745148,"subfield":{"id":"https://openalex.org/subfields/2210","display_name":"Mechanical Engineering"},"field":{"id":"https://openalex.org/fields/22","display_name":"Engineering"},"domain":{"id":"https://openalex.org/domains/3","display_name":"Physical Sciences"}}],"keywords":[{"id":"https://openalex.org/keywords/co2-adsorption","display_name":"CO2 adsorption","score":0.9440000057220459},{"id":"https://openalex.org/keywords/hydrogen-adsorption","display_name":"hydrogen adsorption","score":0.9549999833106995},{"id":"https://openalex.org/keywords/calcite","display_name":"calcite","score":0.7929999828338623},{"id":"https://openalex.org/keywords/slit-shaped-pores","display_name":"slit pores","score":0.8299999833106995},{"id":"https://openalex.org/keywords/gas-diffusion","display_name":"gas diffusion","score":0.6110000014305115},{"id":"https://openalex.org/keywords/adsorption-isotherms","display_name":"adsorption isotherms","score":0.8939999938011169},{"id":"https://openalex.org/keywords/excess-adsorption","display_name":"excess adsorption","score":0.7870000004768372},{"id":"https://openalex.org/keywords/self-diffusion","display_name":"self-diffusion","score":0.8309999704360962},{"id":"https://openalex.org/keywords/maxwell-stefan-diffusion","display_name":"Maxwell-Stefan diffusion","score":0.8740000128746033},{"id":"https://openalex.org/keywords/pore-size-effects","display_name":"pore size effects","score":0.7179999947547913},{"id":"https://openalex.org/keywords/pressure-dependence","display_name":"pressure dependence","score":0.7620000243186951},{"id":"https://openalex.org/keywords/temperature-dependence","display_name":"temperature dependence","score":0.8059999942779541},{"id":"https://openalex.org/keywords/co2-capture","display_name":"CO2 capture","score":0.4099999964237213}],"concepts":[{"id":"https://openalex.org/C2780191791","wikidata":"https://www.wikidata.org/wiki/Q171917","display_name":"Calcite","level":2,"score":0.8746120929718018},{"id":"https://openalex.org/C150394285","wikidata":"https://www.wikidata.org/wiki/Q180254","display_name":"Adsorption","level":2,"score":0.8016126751899719},{"id":"https://openalex.org/C69357855","wikidata":"https://www.wikidata.org/wiki/Q163214","display_name":"Diffusion","level":2,"score":0.7757441997528076},{"id":"https://openalex.org/C185592680","wikidata":"https://www.wikidata.org/wiki/Q2329","display_name":"Chemistry","level":0,"score":0.5822806358337402},{"id":"https://openalex.org/C59593255","wikidata":"https://www.wikidata.org/wiki/Q901663","display_name":"Molecular dynamics","level":2,"score":0.5305583477020264},{"id":"https://openalex.org/C97355855","wikidata":"https://www.wikidata.org/wiki/Q11473","display_name":"Thermodynamics","level":1,"score":0.5010159015655518},{"id":"https://openalex.org/C15696416","wikidata":"https://www.wikidata.org/wiki/Q3027666","display_name":"Surface diffusion","level":3,"score":0.46002545952796936},{"id":"https://openalex.org/C173938606","wikidata":"https://www.wikidata.org/wiki/Q1138138","display_name":"Gaseous diffusion","level":3,"score":0.449823796749115},{"id":"https://openalex.org/C105569014","wikidata":"https://www.wikidata.org/wiki/Q3271208","display_name":"Porous medium","level":3,"score":0.4114246964454651},{"id":"https://openalex.org/C6648577","wikidata":"https://www.wikidata.org/wiki/Q622669","display_name":"Porosity","level":2,"score":0.33845412731170654},{"id":"https://openalex.org/C147789679","wikidata":"https://www.wikidata.org/wiki/Q11372","display_name":"Physical chemistry","level":1,"score":0.2535887360572815},{"id":"https://openalex.org/C199289684","wikidata":"https://www.wikidata.org/wiki/Q83353","display_name":"Mineralogy","level":1,"score":0.2263534963130951},{"id":"https://openalex.org/C178790620","wikidata":"https://www.wikidata.org/wiki/Q11351","display_name":"Organic chemistry","level":1,"score":0.12639805674552917},{"id":"https://openalex.org/C147597530","wikidata":"https://www.wikidata.org/wiki/Q369472","display_name":"Computational chemistry","level":1,"score":0.11937043070793152},{"id":"https://openalex.org/C121332964","wikidata":"https://www.wikidata.org/wiki/Q413","display_name":"Physics","level":0,"score":0.0},{"id":"https://openalex.org/C17525397","wikidata":"https://www.wikidata.org/wiki/Q176140","display_name":"Electrode","level":2,"score":0.0}],"mesh":[],"locations_count":1,"locations":[{"id":"doi:10.1016/j.molliq.2021.118306","doi":"https://doi.org/10.1016/j.molliq.2021.118306","is_oa":false,"landing_page_url":"https://doi.org/10.1016/j.molliq.2021.118306","pdf_url":null,"source":{"id":"https://openalex.org/S189140625","display_name":"Journal of Molecular Liquids","issn_l":"0167-7322","issn":["0167-7322","1873-3166"],"is_oa":false,"is_in_doaj":false,"is_core":true,"listed_in":["cwts-core","jufo-1","ki-jl-1","norway-1","poland-100","russia-white-list-1","vabb-shw"],"host_organization":"https://openalex.org/P4310320990","host_organization_name":"Elsevier BV","host_organization_lineage":["https://openalex.org/P4310320990"],"host_organization_lineage_names":["Elsevier BV"],"type":"journal"},"license":null,"license_id":null,"version":"publishedVersion","is_accepted":true,"is_published":true,"raw_source_name":"Journal of Molecular Liquids","raw_type":"journal-article"}],"best_oa_location":null,"sustainable_development_goals":[{"id":"https://metadata.un.org/sdg/13","display_name":"Climate action","score":0.5351999998092651}],"sustainable_development_goals_aurora":[{"id":"https://metadata.un.org/sdg/7","display_name":"Affordable and clean energy","score":0.49000000953674316}],"study_designs":[],"awards":[{"id":"https://openalex.org/G5371811566","display_name":null,"funder_award_id":"2020CDJQY-A051","funder_id":"https://openalex.org/F4320335787","funder_display_name":"Fundamental Research Funds for the Central Universities"},{"id":"https://openalex.org/G5598060062","display_name":null,"funder_award_id":"51876015","funder_id":"https://openalex.org/F4320321001","funder_display_name":"National Natural Science Foundation of China"},{"id":"https://openalex.org/G73695767","display_name":null,"funder_award_id":"2018YFE0206600","funder_id":"https://openalex.org/F4320335777","funder_display_name":"National Key Research and Development Program of China"}],"funders":[{"id":"https://openalex.org/F4320321001","display_name":"National Natural Science Foundation of China","ror":"https://ror.org/01h0zpd94"},{"id":"https://openalex.org/F4320335777","display_name":"National Key Research and Development Program of China","ror":null},{"id":"https://openalex.org/F4320335787","display_name":"Fundamental Research Funds for the Central Universities","ror":null}],"has_content":{"grobid_xml":false,"pdf":false},"content_urls":null,"referenced_works_count":55,"referenced_works":["https://openalex.org/W950113603","https://openalex.org/W1973260029","https://openalex.org/W1982432087","https://openalex.org/W1986931044","https://openalex.org/W1987153617","https://openalex.org/W1995876178","https://openalex.org/W2001037711","https://openalex.org/W2005005410","https://openalex.org/W2019465613","https://openalex.org/W2033658921","https://openalex.org/W2042699325","https://openalex.org/W2045845086","https://openalex.org/W2047293410","https://openalex.org/W2053557914","https://openalex.org/W2057570964","https://openalex.org/W2059277244","https://openalex.org/W2060548465","https://openalex.org/W2062904068","https://openalex.org/W2070256963","https://openalex.org/W2080330411","https://openalex.org/W2081804051","https://openalex.org/W2086294714","https://openalex.org/W2101046593","https://openalex.org/W2138429893","https://openalex.org/W2154412367","https://openalex.org/W2158762590","https://openalex.org/W2168175046","https://openalex.org/W2318717484","https://openalex.org/W2512030976","https://openalex.org/W2526891438","https://openalex.org/W2625622302","https://openalex.org/W2726396025","https://openalex.org/W2749476575","https://openalex.org/W2755847266","https://openalex.org/W2762180891","https://openalex.org/W2763673921","https://openalex.org/W2781880451","https://openalex.org/W2801572038","https://openalex.org/W2942998504","https://openalex.org/W2948062540","https://openalex.org/W2955879523","https://openalex.org/W2962954967","https://openalex.org/W2981129061","https://openalex.org/W2990737414","https://openalex.org/W2999687148","https://openalex.org/W3003201588","https://openalex.org/W3009423654","https://openalex.org/W3028499834","https://openalex.org/W3042538020","https://openalex.org/W3043130447","https://openalex.org/W3081154292","https://openalex.org/W3087120173","https://openalex.org/W3185124072","https://openalex.org/W4300582731","https://openalex.org/W6676087360"],"related_works":["https://openalex.org/W2064666429","https://openalex.org/W1993587598","https://openalex.org/W278486644","https://openalex.org/W2005752923","https://openalex.org/W1998837657","https://openalex.org/W2063164310","https://openalex.org/W2022786862","https://openalex.org/W2909736133","https://openalex.org/W1980411142","https://openalex.org/W3012519963"],"abstract_inverted_index":null,"counts_by_year":[{"year":2026,"cited_by_count":14},{"year":2025,"cited_by_count":15},{"year":2024,"cited_by_count":17},{"year":2023,"cited_by_count":12},{"year":2022,"cited_by_count":2}],"updated_date":"2026-10-15T10:00:46.086208","created_date":"2025-10-10T00:00:00"}