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The miscible behaviors and mechanism of CO2/CH4/C3H8/N2 and crude oil in nanoslits: A molecular dynamics simulation study
[Display omitted] •The effect of injected gas type and crude oil type on oil-gas miscibility is investigated.•CO2, CH4, C3H8 and N2 could be more miscible with apolar crude oil than polar crude oil.•The chain length of crude oil has different effect on its miscibility with different gas. Using molec...
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Published in: | Fuel (Guildford) 2021-11, Vol.304, p.121461, Article 121461 |
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creator | Wang, Ping Li, Xiaofang Tao, Zhengwu Wang, Sen Fan, Jiawei Feng, Qihong Xue, Qingzhong |
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•The effect of injected gas type and crude oil type on oil-gas miscibility is investigated.•CO2, CH4, C3H8 and N2 could be more miscible with apolar crude oil than polar crude oil.•The chain length of crude oil has different effect on its miscibility with different gas.
Using molecular dynamics simulations, we have investigated the miscible behaviors of different gas (CO2, N2, CH4, C3H8) and different crude oils in nanoslits at 413 K and 60 MPa. In this study, the effect of gas type, the polarity and the chain length of crude oil on the miscible process of gas and crude oil is explored. The simulation results show that CO2, CH4, C3H8 and N2 are more miscible with apolar crude oil than polar crude oil due to the stronger interaction between polar crude oil and silica surface. It is worth noting that the solubility of polar crude oil in CO2 phase is higher than that in hydrocarbon gas phase and N2 phase. In addition, it is found that the chain length of crude oil could affect the dissolution of crude oil in hydrocarbon gas and N2. In contrast, it has a negligible effect on the miscibility of crude oil and CO2. The simulation results could provide valuable guidance for enhancing oil recovery in the development of deep and ultra-deep reservoirs. |
doi_str_mv | 10.1016/j.fuel.2021.121461 |
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•The effect of injected gas type and crude oil type on oil-gas miscibility is investigated.•CO2, CH4, C3H8 and N2 could be more miscible with apolar crude oil than polar crude oil.•The chain length of crude oil has different effect on its miscibility with different gas.
Using molecular dynamics simulations, we have investigated the miscible behaviors of different gas (CO2, N2, CH4, C3H8) and different crude oils in nanoslits at 413 K and 60 MPa. In this study, the effect of gas type, the polarity and the chain length of crude oil on the miscible process of gas and crude oil is explored. The simulation results show that CO2, CH4, C3H8 and N2 are more miscible with apolar crude oil than polar crude oil due to the stronger interaction between polar crude oil and silica surface. It is worth noting that the solubility of polar crude oil in CO2 phase is higher than that in hydrocarbon gas phase and N2 phase. In addition, it is found that the chain length of crude oil could affect the dissolution of crude oil in hydrocarbon gas and N2. In contrast, it has a negligible effect on the miscibility of crude oil and CO2. The simulation results could provide valuable guidance for enhancing oil recovery in the development of deep and ultra-deep reservoirs.</description><identifier>ISSN: 0016-2361</identifier><identifier>EISSN: 1873-7153</identifier><identifier>DOI: 10.1016/j.fuel.2021.121461</identifier><language>eng</language><publisher>Kidlington: Elsevier Ltd</publisher><subject>Carbon dioxide ; Chains ; Crude oil ; Deep reservoir ; Gas flooding ; Hydrocarbons ; Methane ; Miscibility ; Miscible behaviors ; Molecular dynamics ; Molecular dynamics simulation ; Nanoslits ; Oil recovery ; Polarity ; Silica ; Silicon dioxide ; Simulation ; Vapor phases</subject><ispartof>Fuel (Guildford), 2021-11, Vol.304, p.121461, Article 121461</ispartof><rights>2021 Elsevier Ltd</rights><rights>Copyright Elsevier BV Nov 15, 2021</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c243t-b4c7540297cbaf9266c47c276a79a18cb24ee85fec399ba07837d2b3b4f15b963</citedby><cites>FETCH-LOGICAL-c243t-b4c7540297cbaf9266c47c276a79a18cb24ee85fec399ba07837d2b3b4f15b963</cites></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><link.rule.ids>314,780,784,27924,27925</link.rule.ids></links><search><creatorcontrib>Wang, Ping</creatorcontrib><creatorcontrib>Li, Xiaofang</creatorcontrib><creatorcontrib>Tao, Zhengwu</creatorcontrib><creatorcontrib>Wang, Sen</creatorcontrib><creatorcontrib>Fan, Jiawei</creatorcontrib><creatorcontrib>Feng, Qihong</creatorcontrib><creatorcontrib>Xue, Qingzhong</creatorcontrib><title>The miscible behaviors and mechanism of CO2/CH4/C3H8/N2 and crude oil in nanoslits: A molecular dynamics simulation study</title><title>Fuel (Guildford)</title><description>[Display omitted]
•The effect of injected gas type and crude oil type on oil-gas miscibility is investigated.•CO2, CH4, C3H8 and N2 could be more miscible with apolar crude oil than polar crude oil.•The chain length of crude oil has different effect on its miscibility with different gas.
Using molecular dynamics simulations, we have investigated the miscible behaviors of different gas (CO2, N2, CH4, C3H8) and different crude oils in nanoslits at 413 K and 60 MPa. In this study, the effect of gas type, the polarity and the chain length of crude oil on the miscible process of gas and crude oil is explored. The simulation results show that CO2, CH4, C3H8 and N2 are more miscible with apolar crude oil than polar crude oil due to the stronger interaction between polar crude oil and silica surface. It is worth noting that the solubility of polar crude oil in CO2 phase is higher than that in hydrocarbon gas phase and N2 phase. In addition, it is found that the chain length of crude oil could affect the dissolution of crude oil in hydrocarbon gas and N2. In contrast, it has a negligible effect on the miscibility of crude oil and CO2. The simulation results could provide valuable guidance for enhancing oil recovery in the development of deep and ultra-deep reservoirs.</description><subject>Carbon dioxide</subject><subject>Chains</subject><subject>Crude oil</subject><subject>Deep reservoir</subject><subject>Gas flooding</subject><subject>Hydrocarbons</subject><subject>Methane</subject><subject>Miscibility</subject><subject>Miscible behaviors</subject><subject>Molecular dynamics</subject><subject>Molecular dynamics simulation</subject><subject>Nanoslits</subject><subject>Oil recovery</subject><subject>Polarity</subject><subject>Silica</subject><subject>Silicon dioxide</subject><subject>Simulation</subject><subject>Vapor phases</subject><issn>0016-2361</issn><issn>1873-7153</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2021</creationdate><recordtype>article</recordtype><recordid>eNp9kMtKxDAUhoMoOI6-gKuA687k1qYVN1LUEQbd6Dok6SmToU00aQf69nYc164OHL7_XD6EbilZUUKL9X7VjtCtGGF0RRkVBT1DC1pKnkma83O0IDOVMV7QS3SV0p4QIstcLND0sQPcu2Sd6QAb2OmDCzFh7Rvcg91p71KPQ4vrd7auN2Jd8025fmO_gI1jAzi4DjuPvfYhdW5I9_gR96EDO3Y64mbyunc24eT6uTG44HEaxma6Rhet7hLc_NUl-nx--qg32fb95bV-3GaWCT5kRliZC8IqaY1uK1YUVkjLZKFlpWlpDRMAZd6C5VVl9PwWlw0z3IiW5qYq-BLdneZ-xfA9QhrUPozRzysVy8vZQ87FkWInysaQUoRWfUXX6zgpStRRsdqro2J1VKxOiufQwykE8_0HB1HNHsFbaFwEO6gmuP_iPy1sg8I</recordid><startdate>20211115</startdate><enddate>20211115</enddate><creator>Wang, Ping</creator><creator>Li, Xiaofang</creator><creator>Tao, Zhengwu</creator><creator>Wang, Sen</creator><creator>Fan, Jiawei</creator><creator>Feng, Qihong</creator><creator>Xue, Qingzhong</creator><general>Elsevier Ltd</general><general>Elsevier BV</general><scope>AAYXX</scope><scope>CITATION</scope><scope>7QF</scope><scope>7QO</scope><scope>7QQ</scope><scope>7SC</scope><scope>7SE</scope><scope>7SP</scope><scope>7SR</scope><scope>7T7</scope><scope>7TA</scope><scope>7TB</scope><scope>7U5</scope><scope>8BQ</scope><scope>8FD</scope><scope>C1K</scope><scope>F28</scope><scope>FR3</scope><scope>H8D</scope><scope>H8G</scope><scope>JG9</scope><scope>JQ2</scope><scope>KR7</scope><scope>L7M</scope><scope>L~C</scope><scope>L~D</scope><scope>P64</scope></search><sort><creationdate>20211115</creationdate><title>The miscible behaviors and mechanism of CO2/CH4/C3H8/N2 and crude oil in nanoslits: A molecular dynamics simulation study</title><author>Wang, Ping ; Li, Xiaofang ; Tao, Zhengwu ; Wang, Sen ; Fan, Jiawei ; Feng, Qihong ; Xue, Qingzhong</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c243t-b4c7540297cbaf9266c47c276a79a18cb24ee85fec399ba07837d2b3b4f15b963</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2021</creationdate><topic>Carbon dioxide</topic><topic>Chains</topic><topic>Crude oil</topic><topic>Deep reservoir</topic><topic>Gas flooding</topic><topic>Hydrocarbons</topic><topic>Methane</topic><topic>Miscibility</topic><topic>Miscible behaviors</topic><topic>Molecular dynamics</topic><topic>Molecular dynamics simulation</topic><topic>Nanoslits</topic><topic>Oil recovery</topic><topic>Polarity</topic><topic>Silica</topic><topic>Silicon dioxide</topic><topic>Simulation</topic><topic>Vapor phases</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Wang, Ping</creatorcontrib><creatorcontrib>Li, Xiaofang</creatorcontrib><creatorcontrib>Tao, Zhengwu</creatorcontrib><creatorcontrib>Wang, Sen</creatorcontrib><creatorcontrib>Fan, Jiawei</creatorcontrib><creatorcontrib>Feng, Qihong</creatorcontrib><creatorcontrib>Xue, Qingzhong</creatorcontrib><collection>CrossRef</collection><collection>Aluminium Industry Abstracts</collection><collection>Biotechnology Research Abstracts</collection><collection>Ceramic Abstracts</collection><collection>Computer and Information Systems Abstracts</collection><collection>Corrosion Abstracts</collection><collection>Electronics & Communications Abstracts</collection><collection>Engineered Materials Abstracts</collection><collection>Industrial and Applied Microbiology Abstracts (Microbiology A)</collection><collection>Materials Business File</collection><collection>Mechanical & Transportation Engineering Abstracts</collection><collection>Solid State and Superconductivity Abstracts</collection><collection>METADEX</collection><collection>Technology Research Database</collection><collection>Environmental Sciences and Pollution Management</collection><collection>ANTE: Abstracts in New Technology & Engineering</collection><collection>Engineering Research Database</collection><collection>Aerospace Database</collection><collection>Copper Technical Reference Library</collection><collection>Materials Research Database</collection><collection>ProQuest Computer Science Collection</collection><collection>Civil Engineering Abstracts</collection><collection>Advanced Technologies Database with Aerospace</collection><collection>Computer and Information Systems Abstracts Academic</collection><collection>Computer and Information Systems Abstracts Professional</collection><collection>Biotechnology and BioEngineering Abstracts</collection><jtitle>Fuel (Guildford)</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Wang, Ping</au><au>Li, Xiaofang</au><au>Tao, Zhengwu</au><au>Wang, Sen</au><au>Fan, Jiawei</au><au>Feng, Qihong</au><au>Xue, Qingzhong</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>The miscible behaviors and mechanism of CO2/CH4/C3H8/N2 and crude oil in nanoslits: A molecular dynamics simulation study</atitle><jtitle>Fuel (Guildford)</jtitle><date>2021-11-15</date><risdate>2021</risdate><volume>304</volume><spage>121461</spage><pages>121461-</pages><artnum>121461</artnum><issn>0016-2361</issn><eissn>1873-7153</eissn><abstract>[Display omitted]
•The effect of injected gas type and crude oil type on oil-gas miscibility is investigated.•CO2, CH4, C3H8 and N2 could be more miscible with apolar crude oil than polar crude oil.•The chain length of crude oil has different effect on its miscibility with different gas.
Using molecular dynamics simulations, we have investigated the miscible behaviors of different gas (CO2, N2, CH4, C3H8) and different crude oils in nanoslits at 413 K and 60 MPa. In this study, the effect of gas type, the polarity and the chain length of crude oil on the miscible process of gas and crude oil is explored. The simulation results show that CO2, CH4, C3H8 and N2 are more miscible with apolar crude oil than polar crude oil due to the stronger interaction between polar crude oil and silica surface. It is worth noting that the solubility of polar crude oil in CO2 phase is higher than that in hydrocarbon gas phase and N2 phase. In addition, it is found that the chain length of crude oil could affect the dissolution of crude oil in hydrocarbon gas and N2. In contrast, it has a negligible effect on the miscibility of crude oil and CO2. The simulation results could provide valuable guidance for enhancing oil recovery in the development of deep and ultra-deep reservoirs.</abstract><cop>Kidlington</cop><pub>Elsevier Ltd</pub><doi>10.1016/j.fuel.2021.121461</doi></addata></record> |
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subjects | Carbon dioxide Chains Crude oil Deep reservoir Gas flooding Hydrocarbons Methane Miscibility Miscible behaviors Molecular dynamics Molecular dynamics simulation Nanoslits Oil recovery Polarity Silica Silicon dioxide Simulation Vapor phases |
title | The miscible behaviors and mechanism of CO2/CH4/C3H8/N2 and crude oil in nanoslits: A molecular dynamics simulation study |
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