{"title":"不同压力下CO2在纳米通道中驱替页岩油的微观机理","authors":"Fengjiao Wang, Haiying Liao* and Quanqi Dai, ","doi":"10.1021/acsomega.4c1062510.1021/acsomega.4c10625","DOIUrl":null,"url":null,"abstract":"<p >Aiming at the problems of unclear utilization degree of shale oil in different occurrence states. In this paper, the CO<sub>2</sub> displacement process of shale oil under different pressure conditions is simulated by the molecular dynamics method, the microscopic mechanism of CO<sub>2</sub> displacement of shale oil is clarified, and the influence of pressure on the utilization degree of different occurrence states of shale oil is revealed. The results show that CO<sub>2</sub> cannot form an effective flow channel under low pressure (1 MPa), and most of the oil and water remain in the channel. The water molecules form a water bridge at the outlet of the pore that CO<sub>2</sub> cannot break through under medium pressure conditions (5 and 10 MPa). CO<sub>2</sub> forms a stable flow channel under high pressure (15 MPa). With the increase of displacement pressure, the kinetic energy of oil and gas molecules in the channel increases. But limited by the system space, the diffusion capacity of shale oil system, the degree of oil and gas miscibility, and the competitive adsorption effect all show a trend of increasing first, then stabilizing, and rapidly increasing at last. The final recoveries of shale oil are 33.24%, 75.82%, 64.69%, and 83.03% under different displacement pressure conditions. Among them, the degree of oil and gas miscibility and shale oil utilization in the adsorbed layer is higher than that in the free layer under 1 MPa condition. And the shale oil utilization degree in the free layer is higher than that in the adsorbed layer under the other pressure conditions. This study can provide a theoretical basis for efficient development of shale oil.</p>","PeriodicalId":22,"journal":{"name":"ACS Omega","volume":"10 16","pages":"16319–16326 16319–16326"},"PeriodicalIF":4.3000,"publicationDate":"2025-04-16","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://pubs.acs.org/doi/epdf/10.1021/acsomega.4c10625","citationCount":"0","resultStr":"{\"title\":\"Microscopic Mechanism for the Displacement of Shale Oil in a Nanochannel by CO2 at Different Pressures\",\"authors\":\"Fengjiao Wang, Haiying Liao* and Quanqi Dai, \",\"doi\":\"10.1021/acsomega.4c1062510.1021/acsomega.4c10625\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p >Aiming at the problems of unclear utilization degree of shale oil in different occurrence states. In this paper, the CO<sub>2</sub> displacement process of shale oil under different pressure conditions is simulated by the molecular dynamics method, the microscopic mechanism of CO<sub>2</sub> displacement of shale oil is clarified, and the influence of pressure on the utilization degree of different occurrence states of shale oil is revealed. The results show that CO<sub>2</sub> cannot form an effective flow channel under low pressure (1 MPa), and most of the oil and water remain in the channel. The water molecules form a water bridge at the outlet of the pore that CO<sub>2</sub> cannot break through under medium pressure conditions (5 and 10 MPa). CO<sub>2</sub> forms a stable flow channel under high pressure (15 MPa). With the increase of displacement pressure, the kinetic energy of oil and gas molecules in the channel increases. But limited by the system space, the diffusion capacity of shale oil system, the degree of oil and gas miscibility, and the competitive adsorption effect all show a trend of increasing first, then stabilizing, and rapidly increasing at last. The final recoveries of shale oil are 33.24%, 75.82%, 64.69%, and 83.03% under different displacement pressure conditions. Among them, the degree of oil and gas miscibility and shale oil utilization in the adsorbed layer is higher than that in the free layer under 1 MPa condition. And the shale oil utilization degree in the free layer is higher than that in the adsorbed layer under the other pressure conditions. This study can provide a theoretical basis for efficient development of shale oil.</p>\",\"PeriodicalId\":22,\"journal\":{\"name\":\"ACS Omega\",\"volume\":\"10 16\",\"pages\":\"16319–16326 16319–16326\"},\"PeriodicalIF\":4.3000,\"publicationDate\":\"2025-04-16\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://pubs.acs.org/doi/epdf/10.1021/acsomega.4c10625\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"ACS Omega\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://pubs.acs.org/doi/10.1021/acsomega.4c10625\",\"RegionNum\":3,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"ACS Omega","FirstCategoryId":"92","ListUrlMain":"https://pubs.acs.org/doi/10.1021/acsomega.4c10625","RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
Microscopic Mechanism for the Displacement of Shale Oil in a Nanochannel by CO2 at Different Pressures
Aiming at the problems of unclear utilization degree of shale oil in different occurrence states. In this paper, the CO2 displacement process of shale oil under different pressure conditions is simulated by the molecular dynamics method, the microscopic mechanism of CO2 displacement of shale oil is clarified, and the influence of pressure on the utilization degree of different occurrence states of shale oil is revealed. The results show that CO2 cannot form an effective flow channel under low pressure (1 MPa), and most of the oil and water remain in the channel. The water molecules form a water bridge at the outlet of the pore that CO2 cannot break through under medium pressure conditions (5 and 10 MPa). CO2 forms a stable flow channel under high pressure (15 MPa). With the increase of displacement pressure, the kinetic energy of oil and gas molecules in the channel increases. But limited by the system space, the diffusion capacity of shale oil system, the degree of oil and gas miscibility, and the competitive adsorption effect all show a trend of increasing first, then stabilizing, and rapidly increasing at last. The final recoveries of shale oil are 33.24%, 75.82%, 64.69%, and 83.03% under different displacement pressure conditions. Among them, the degree of oil and gas miscibility and shale oil utilization in the adsorbed layer is higher than that in the free layer under 1 MPa condition. And the shale oil utilization degree in the free layer is higher than that in the adsorbed layer under the other pressure conditions. This study can provide a theoretical basis for efficient development of shale oil.
ACS OmegaChemical Engineering-General Chemical Engineering
CiteScore
6.60
自引率
4.90%
发文量
3945
审稿时长
2.4 months
期刊介绍:
ACS Omega is an open-access global publication for scientific articles that describe new findings in chemistry and interfacing areas of science, without any perceived evaluation of immediate impact.