Competitive adsorption and microscopic wetting properties in CO₂-H₂O-rock systems: A review

Chi Zhang, Yan Zhang, Yi Su, Linyang Zhang, Xinran Yu

Abstract view|31|times       PDF download|15|times

Abstract


At the microscopic scale, the competitive adsorption of CO₂ and H₂O alters the inter facial characteristics of rock surfaces, thereby inducing significant deviations between the microscopic wetting properties and macroscopic behaviors, a phenomenon critically impacting unconventional hydrocarbon extraction. Consequently, this paper analyzes the interfacial interactions and microscopic adsorption mechanisms of CO₂ and H₂O on rock surfaces at the molecular level and characterizes the properties of their adsorption layers. Building on this foundation, existing models of competitive adsorption and adsorption energy are summarized, revealing how alterations in interfacial properties affect wettability. Furthermore, the influence of surface energy, surface tension, surface roughness, organic content, and pore structure on the contact angle is discussed, along with the applicability and limitations of contact angle theoretical models. Overall, this paper proposes a method to achieve the accurate characterization of microscopic wetting behavior by incorporating correction coefficients (e.g., adsorption energy, surface roughness) into macroscopic models.

Document Type: Invited review

Cited as: Zhang, C., Zhang, Y., Su, Y., Zhang, L., Yu, X. Competitive adsorption and microscopic wetting properties in CO₂-H₂O-rock systems: A review. Capillarity, 2025, 16(3): 61-76. https://doi.org/10.46690/capi.2025.09.01


Keywords


Microscopic wetting, microscopic adsorption, competitive adsorption, adsorption energy, contact angle

Full Text:

PDF

References


Afekare, D., Garno, J. C., Rao, D. Insights into nanoscale wettability effects of low salinity and nanofluid enhanced oil recovery techniques. Energies, 2020, 13(17): 4443.

Alhammad, F., Ali, M., Yekeen, N., et al. The influence of methyl orange on the CO2-brine wettability of organic-acid-aged calcite samples: Implications for CO2 geostorage. Advances in Geo-Energy Research, 2024, 12(2): 102-112.

Alzahrani, M. K., Shapoval, A., Chen, Z., et al. Micrographnets: Automated characterization of the micro-scale wettability of porous media using graph neural networks. Capillarity, 2024, 12(3): 57-71.

An, X., Zhao, K., Zhang, W., et al. Tailoring the pore structure modified with functional groups for superior CO2 adsorption capacity and the selectivity of separation. Fuel, 2022, 309: 122175.

Aryana, S., Kovscek, A., Prodanović, M., et al. The international symposium on wettability and porous media-past, present, and the future. Paper IPJ 240824-3 Presented at 15th International Symposium on Wettability and Porous Media, Laramie, Wyoming, 23-25 October, 2023.

Aybar, M., Zhang, H., Qiao, R., et al. Molecular structure and thermodynamics of CO2 and water adsorption on mica. The Journal of Physical Chemistry B, 2025, 129(18): 4558-4568.

Bai, B. C., Kim, E. A., Lee, C. W., et al. Effects of surface chemical properties of activated carbon fibers modified by liquid oxidation for CO2 adsorption. Applied Surface Science, 2015, 353: 158-164.

Ballah, J., Chamerois, M., Durand-Vidal, S., et al. Effect of chemical and geometrical parameters influencing the wettability of smectite clay films. Colloids and Surfaces A: Physicochemical and Engineering Aspects, 2016, 511: 255-263.

Barberi, J., Spriano, S. Titanium and protein adsorption: An overview of mechanisms and effects of surface features. Materials, 2021, 14(7): 1590.

Bormashenko, E. General equation describing wetting of rough surfaces. Journal of Colloid and Interface Science, 2011, 360(1): 317-319.

Cabriga, C. K. C., Clarete, K. V. B., Zhang, J. A. T., et al. Evaluation of biochar derived from the slow pyrolysis of rice straw as a potential adsorbent for carbon dioxide. Biomass Conversion and Biorefinery, 2023, 13(9): 7887-7894.

Cai, J., Jiao, X., Wang, H., et al. Multiphase fluid-rock inter actions and flow behaviors in shale nanopores: A com prehensive review. Earth-Science Reviews, 2024, 257: 104884.

Cao, X., Ma, Y., Cao, H., et al. Molecular dynamics simulation study on the wetting characteristics of carbon dioxide droplets on smooth and rough surfaces. Journal of Molecular Liquids, 2024, 403: 124835.

Cassie, A., Baxter, S. Wettability of porous surfaces. Transactions of the Faraday Society, 1944, 40: 546-551.

Chaconas, D., Pichardo, P., Manousiouthakis, I. V., et al. Equilibrium analysis of CH4, CO, CO2, H2O, H2, C mixtures in C-H-O atom space using gibbs free energy global minimization. American Institute of Chemical Engineers Journal, 2021, 67(1): e17052.

Chen, Y., Seyyedi, M., Clennell, B. Petrophysical recipe for in-situ CO2 mineralization in basalt rocks. Advances in Geo-Energy Research, 2024, 11(2): 152-160.

Cheng, Y., Chu, K., Tsao, H. K., et al. Size-dependent behavior and failure of young’s equation for wetting of two-component nanodroplets. Journal of Colloid and Interface Science, 2020, 578: 69-76.

Cui, J., Bao, J., Ning, S., et al. Molecular simulation of the impact of surface roughness on carbon dioxide adsorption in organic-rich shales. Unconventional Resources, 2024, 4: 100071.

Deglint, H., Clarkson, C., Ghanizadeh, A., et al. Comparison of micro-and macro-wettability measurements and evaluation of micro-scale imbibition rates for unconventional reservoirs: Implications for modeling multi-phase flow at the micro-scale. Journal of Natural Gas Science and Engineering, 2019, 62: 38-67.

Deng, X., Kamal, M. S., Hussain, S. M. S., et al. Impact of organic acid molecular length and structure on rock oil-wetting rapidity and stability. Journal of Molecular Structure, 2025, 1321: 140009.

Didier, G., Nguyen, H. Asymptotic analysis of the mean squared displacement under fractional memory kernels. Society for Industrial and Applied Mathematics Journal on Mathematical Analysis, 2020, 52(4): 3818-3842.

Dong, X., Xu, W., Liu, H., et al. Molecular insight into the oil displacement mechanism of CO2 flooding in the nanopores of shale oil reservoir. Petroleum Science, 2023, 20(6): 3516-3529.

Du, X., Guang, W., Cheng, Y., et al. Thermodynamics analysis of the adsorption of CH4 and CO2 on montmorillonite. Applied Clay Science, 2020, 192: 105631.

Fan, W., Xin, Q., Dai, Y., et al. Competitive transport and adsorption of CO2/H2O in the graphene nano-slit pore: A molecular dynamics simulation study. Separation and Purification Technology, 2025, 353: 128394.

Fang, T., Shi, J., Sun, X., et al. Supercritical CO2 selective extraction inducing wettability alteration of oil reservoir. The Journal of Supercritical Fluids, 2016, 113: 10-15.

Fatah, A., Bennour, Z., Mahmud, H. B., et al. Surface wettability alteration of shales exposed to CO2: Implication for long-term integrity of geological storage sites. International Journal of Greenhouse Gas Control, 2021, 110: 103426.

Fauziah, C. A., Al-Yaseri, A. Z., Beloborodov, R., et al. Carbon dioxide/brine, nitrogen/brine, and oil/brine wettability of montmorillonite, illite, and kaolinite at elevated pressure and temperature. Energy & Fuels, 2018, 33(1): 441-448.

Fernandez-Alos, V., Watson, J. K., vander Wal, R., et al. Soot and char molecular representations generated directly from HRTEM lattice fringe images using Fringe3D. Combustion and Flame, 2011, 158(9): 1807-1813.

Ferrari, B. C., Bennett, C. J. A computational investigation of the equilibrium geometries, energetics, vibrational frequencies, infrared intensities and Raman activities of C2Oy (y=3,4) species. Molecular Physics, 2021, 119(6): e1837404.

Fu, D., Davis, M. E. Carbon dioxide capture with zeotype ma terials. Chemical Society Reviews, 2022, 51(22): 9340-9370.

Fukuma, T., Garcia, R. Atomic-and molecular-resolution mapping of solid-liquid interfaces by 3D atomic force microscopy. American Chemical Society Nano, 2018, 12(12): 11785-11797.

Grekov, D. I., Robinet, J. C., Grambow, B. Adsorption of methane and carbon dioxide by water-saturated clay minerals and clay rocks. Applied Clay Science, 2023, 232: 106806.

Gunawardene, O. H., Gunathilake, C. A., Vikrant, K., et al. Carbon dioxide capture through physical and chemical adsorption using porous carbon materials: A review. Atmosphere, 2022, 13(3): 397.

Hantal, G. R., Sega, M., Horvai, G., et al. Contribution of different molecules and moieties to the surface tension in aqueous surfactant solutions. The Journal of Physical Chemistry C, 2019, 123(27): 16660-16670.

He, X., Luo, L. A priori derivation of the lattice Boltzmann equation. Physical Review E, 1997, 55(6): R6333.

He, Y., Wang, J., Huang, X., et al. Investigation of low water recovery based on gas-water two-phase low-velocity Non-Darcy flow model for hydraulically fractured horizontal wells in shale. Petroleum, 2023a, 9(3): 364-372.

He, M., Zhao, H., Yang, X., et al. Reconsideration about the competitive adsorption of H2O and CO2 on carbon surfaces: The influence of oxygen functional groups. Journal of Environmental Chemical Engineering, 2023b, 11(6): 111288.

Hou, D., Gong, F., Tang, H., et al. Molecule simulation of CH4/CO2 competitive adsorption and CO2 storage in shale montmorillonite. Atmosphere, 2022, 13(10): 1565.

Hu, M., Gao, W., Zhang, L., et al. Simulation study on diffusion and local structure of CH4, CO2, SO2, and H2O mixtures into double-layers graphene. The Journal of Physical Chemistry B, 2024, 128(46): 11402-11416.

Hu, R., Wan, J., Kim, Y., et al. Wettability impact on supercritical CO2 capillary trapping: Pore-scale visualization and quantification. Water Resources Research, 2017, 53(8): 6377-6394.

Huang, L., Ning, Z., Wang, Q., et al. Molecular simulation of adsorption behaviors of methane, carbon dioxide and their mixtures on kerogen: Effect of kerogen maturity and moisture content. Fuel, 2018, 211: 159-172.

Huang, L., Ning, Z., Wang, Q., et al. Molecular insights into kerogen deformation induced by CO2/CH4 sorption: Effect of maturity and moisture. Energy & Fuels, 2019, 33(6): 4792-4805.

Hubao, A., Yang, Z., Hu, R., et al. Molecular origin of wetting characteristics on mineral surfaces. Langmuir: the American Chemical Society Journal of Surfaces and Colloids, 2023, 39(8): 2932-2942.

Iglauer, S., Pentland, C., Busch, A. CO2 wettability of seal and reservoir rocks and the implications for carbon geo-sequestration. Water Resources Research, 2015, 51(1): 729-774.

Israelachvili, J., Pashley, R. The hydrophobic interaction is long range, decaying exponentially with distance. Nature, 1982, 300(5890): 341-342.

Jawerth, L., Fischer-Friedrich, E., Saha, S., et al. Protein condensates as aging maxwell fluids. Science, 2020, 370(6522): 1317-1323.

Jeong, W., Kim, J. Understanding the mechanisms of CO2 adsorption enhancement in pure silica zeolites under humid conditions. The Journal of Physical Chemistry C, 2016, 120(41): 23500-23510.

Jia, Z., Ning, Z., Gao, X., et al. Experimental investigation on molecular-scale mechanism of wettability alteration induced by supercritical carbon dioxide-water-rock reaction. Journal of Petroleum Science and Engineering, 2021, 205: 108798.

Jia, C., Xiao, B., You, L., et al. Experimental study of water imbibition characteristics of the lacustrine shale in Sichuan Basin. Petroleum, 2023, 9(4): 572-578.

Joos, L., Swisher, J. A., Smit, B. Molecular simulation study of the competitive adsorption of H2O and CO2 in zeolite 13X. Langmuir, 2013, 29(51): 15936-15942.

Jørgensen, M., Chen, L., Gronbeck, H. Monte carlo potential energy sampling for molecular entropy in zeolites. The Journal of Physical Chemistry C, 2018, 122(35): 20351-20357.

Josyula, T., Kumar Malla, L., Thomas, T. M., et al. Funda mentals and applications of surface wetting. Langmuir, 2024, 40(16): 8293-8326.

Karas, L. J., Wu, C. H., Das, R., et al. Hydrogen bond design principles. Wiley Interdisciplinary Reviews: Computa tional Molecular Science, 2020, 10(6): e1477.

Kashkooli, S. B., Gandomkar, A., Riazi, M., et al. Coupled optimization of carbon dioxide sequestration and CO2 enhanced oil recovery. Journal of Petroleum Science and Engineering, 2022, 208: 109257.

Khan, M. J., Mahmood, S. M., Alakbari, F. S., et al. Rock wettability and its implication for caprock integrity in CO2-brine systems: A comprehensive review. Energy & Fuels, 2024, 38(21): 19966-19991.

Kim, K., Kundzicz, P. M., Makhnenko, R. Y. Effect of CO2 injection on the multiphase flow properties of reservoir rock. Transport in Porous Media, 2023, 147(2): 429-461.

Kolle, J. M., Fayaz, M., Sayari, A. Understanding the effect of water on CO2 adsorption. Chemical Reviews, 2021, 121(13): 7280-7345.

Kraevsky, S. V., Valueva, A. A., Ershova, M. O., et al. Using the radial distribution function to analyze atomic force microscopy images of colloidal systems. International Journal of Molecular Sciences, 2024, 26(1): 210.

Kryuchkov, N. P., Nasyrov, A. D., Denisenko, I. R., et al. Interpolating the radial distribution function in a two-dimensional fluid across a wide temperature range. The Journal of Chemical Physics, 2024, 161: 094505.

Lawal, L. O., Olayiwola, T., Abdel-Azeim, S., et al. Molecular simulation of kerogen-water interaction: Theoretical insights into maturity. Journal of Molecular Liquids, 2020, 299: 112224.

Li, W., Cao, J., Liang, Y., et al. Molecular simulation of methane/ethane mixture adsorption behavior in shale nanopore systems with micropores and mesopores. Fuel, 2024a, 358: 130294.

Li, Y., Chen, Y., Zhao, J., et al. Interaction mechanism between supercritical carbon dioxide and shale. Oil & Gas Geology, 2024b, 45(4): 1180-1194. (in Chinese)

Li, L., Lu, J., Fang, H., et al. Lattice Boltzmann method for fluid-thermal systems: Status, hotspots, trends and outlook. IEEE Access, 2020a, 8: 27649-27675.

Li, X., Reinhoudt, D., Crego-Calama, M. What do we need for a superhydrophobic surface? A review on the recent progress in the preparation of superhydrophobic surfaces. Chemical Society Reviews, 2007, 36(8): 1350-1368.

Li, W., Zhang, M., Nan, Y., et al. Molecular dynamics study on CO2 storage in water-filled kerogen nanopores in shale reservoirs: Effects of kerogen maturity and pore size. Langmuir, 2020b, 37(1): 542-552.

Li, L., Zhang, D., Su, Y., et al. Microfluidic insights into CO2 sequestration and enhanced oil recovery in laminated shale reservoirs: Post-fracturing interface dynamics and micro-scale mechanisms. Advances in Geo-Energy Research, 2024c, 13(3): 203-217.

Liang, Y., Tsuji, S., Jia, J., et al. Modeling CO2-water-mineral wettability and mineralization for carbon geosequestration. Accounts of Chemical Research, 2017, 50(7): 1530 1540.

Liao, X., Lu, R., Xia, L., et al. Density functional theory for electrocatalysis. Energy & Environmental Materials, 2022, 5(1): 157-185.

Lin, X., Li, Z., Jiang, Z., et al. Simulation of methane occurrence in rough nanokerogen slits. Energy & Fuels, 2023, 37(20): 15476-15489.

Liu, L., Frouté, L., Kovscek, A. R., et al. Scale translation yields insights into gas adsorption under nanoconfinement. Physics of Fluids, 2024, 36(7): 072011.

Lv, P., Liu, Y., Jiang, L., et al. Experimental determination of wettability and heterogeneity effect on CO2 distribution in porous media. Greenhouse Gases: Science and Technology, 2016, 6(3): 401-415.

Ma, X., Wang, H., Zhou, S., et al. Deep shale gas in china: Geological characteristics and development strategies. Energy Reports, 2021, 7: 1903-1914.

Mendel, N., Sîretanu, D., Sîretanu, I., et al. Interlayer cation-controlled adsorption of carbon dioxide in anhydrous montmorillonite clay. The Journal of Physical Chemistry C, 2021, 125(49): 27159-27169.

Mirchi, V., Dejam, M., Alvarado, V. Interfacial tension and contact angle measurements for hydrogen-methane mixtures/brine/oil-wet rocks at reservoir conditions. International Journal of Hydrogen Energy, 2022, 47(82): 34963-34975.

Miyazawa, K., Kobayashi, N., Watkins, M., et al. A relationship between three-dimensional surface hydration structures and force distribution measured by atomic force microscopy. Nanoscale, 2016, 8(13): 7334-7342.

Monroe, J., Barry, M., DeStefano, A., et al. Water structure and properties at hydrophilic and hydrophobic surfaces. Annual Review of Chemical and Biomolecular Engineering, 2020, 11(1): 523-557.

Mouzon, J., Bhuiyan, I. U., Hedlund, J. The structure of montmorillonite gels revealed by sequential cryo-XHR-SEM imaging. Journal of Colloid and Interface Science, 2016, 465: 58-66.

Muhammed, N. S., Haq, B., Al Shehri, D. CO2 rich cushion gas for hydrogen storage in depleted gas reservoirs: Insight on contact angle and surface tension. International Journal of Hydrogen Energy, 2024, 50: 1281-1301.

Nabizadeh, A., Hassanzadeh, H., Sharifi, M., et al. Effects of dynamic contact angle on immiscible two-phase flow displacement in angular pores: A computational fluid dynamics approach. Journal of Molecular Liquids, 2019, 292: 111457.

Nandi, M., Uyama, H. Exceptional CO2 adsorbing materials under different conditions. The Chemical Record, 2014, 14(6): 1134-1148.

Nasralla, R. A., Nasr-El-Din, H. A. Double-layer expansion: Is it a primary mechanism of improved oil recovery by low-salinity waterflooding? Society of Petroleum Engineers Reservoir Evaluation & Engineering, 2014, 17(1): 49-59.

Nemer, M. N., Rao, P. R., Schaefer, L. Coupled influence of wettability alteration and geometry on two-phase flow in porous media. Advances in Water Resources, 2021, 157: 104055.

Nie, H., Jin, Z., Li, P., et al. Deep shale gas in the Ordovician-Silurian Wufeng-Longmaxi formations of the Sichuan Basin, SW china: Insights from reservoir characteristics, preservation conditions and development strategies. Jour nal of Asian Earth Sciences, 2023, 244: 105521.

Nowrouzi, I., Manshad, A. K., Mohammadi, A. H. Effects of ions and dissolved carbon dioxide in brine on wettability alteration, contact angle and oil production in smart water and carbonated smart water injection processes in carbonate oil reservoirs. Fuel, 2019, 235: 1039-1051.

Pan, B., Gong, C., Wang, X., et al. The interfacial properties of clay-coated quartz at reservoir conditions. Fuel, 2020, 262: 116461.

Pan, S., Guo, R., Björnmalm, M., et al. Coatings super-repellent to ultralow surface tension liquids. Nature Ma terials, 2018, 17(11): 1040-1047.

Park, J., Han, H. S., Kim, Y. C., et al. Direct and accurate measurement of size dependent wetting behaviors for sessile water droplets. Scientific Reports, 2015, 5(1): 18150.

Parker, J. L., Claesson, P. M., Attard, P. Bubbles, cavities, and the long-ranged attraction between hydrophobic surfaces. The Journal of Physical Chemistry, 1994, 98(34): 8468-8480.

Purdue, M. J., Qiao, Z. Molecular simulation study of wet f lue gas adsorption on zeolite 13X. Microporous and Mesoporous Materials, 2018, 261: 181-197.

Qin, X., Xia, Y., Qiao, J., et al. Modeling of multiphase flow in low permeability porous media: Effect of wettability and pore structure properties. Journal of Rock Mechanics and Geotechnical Engineering, 2024, 16(4): 1127-1139.

Rao, Q., Leng, Y. Molecular understanding of CO2 and H2O in a montmorillonite clay interlayer under CO2 geological sequestration conditions. The Journal of Physical Chemistry C, 2016, 120(5): 2642-2654.

Raza, A., Mahmoud, M., Alafnan, S., et al. H2, CO2, and CH4 adsorption potential of kerogen as a function of pressure, temperature, and maturity. International Journal of Molecular Sciences, 2022, 23(21): 12767.

Ruthven, D. M. Principles of Adsorption and Adsorption Processes. New York, USA, John Wiley & Sons, 1984.

Selem, A. M., Agenet, N., Blunt, M. J., et al. Pore-scale processes in tertiary low salinity waterflooding in a carbonate rock: Micro-dispersions, water film growth, and wettability change. Journal of Colloid and Interface Science, 2022, 628: 486-498.

Shao, Z., Tan, B., Li, T., et al. Study on oxidation and pyrolysis characteristics of lignite damaged by liquid CO2 at low temperature. Fuel, 2022, 323: 124371.

Sharma, A., Namsani, S., Singh, J. K. Molecular simulation of shale gas adsorption and diffusion in inorganic nanopores. Molecular Simulation, 2015, 41(5-6): 414-422.

Shen, C., Worek, W. Cosorption characteristics of solid adsorbents. International Journal of Heat and Mass Transfer, 1994, 37(14): 2123-2129.

Snoeijer, J. H., Andreotti, B. A microscopic view on contact angle selection. Physics of Fluids, 2008, 20: 057101.

Song, W., Liu, F., Li, Y., et al. Pore scale modeling of fluid transport in complex reservoirs: Multi-scale digital rock construction, flow experiments and simulation methods. Capillarity, 2024, 11(3): 81-88.

Song, P., Wang, H. High-performance polymeric materials through hydrogen-bond cross-linking. Advanced Materials, 2020, 32(18): 1901244.

Sui, H., Zhang, F., Wang, Z., et al. Effect of kerogen maturity, water content for carbon dioxide, methane, and their mixture adsorption and diffusion in kerogen: A computational investigation. Langmuir, 2020, 36(33): 9756-9769.

Sun, J., Chen, C., Zhang, Y., et al. Competitive adsorption characteristics based on partial pressure and adsorption mechanism of CO2/CH4 mixture in shale pores. Chemical Engineering Journal, 2022, 430: 133172.

Tesson, S., Firoozabadi, A. Methane adsorption and self-diffusion in shale kerogen and slit nanopores by molecular simulations. The Journal of Physical Chemistry C, 2018, 122(41): 23528-23542.

Tian, X., Kalbasi, R., Jahanshahi, R., et al. Competition between intermolecular forces of adhesion and cohesion in the presence of graphene nanoparticles: Investigation of graphene nanosheets/ethylene glycol surface tension. Journal of Molecular Liquids, 2020, 311: 113329.

Van Honschoten, J. W., Brunets, N., Tas, N. R. Capillarity at the nanoscale. Chemical Society Reviews, 2010, 39(3): 1096-1114.

Wang, H., Cai, J., Su, Y., et al. Pore-scale study on shale oil CO2-water miscibility, competitive adsorption, and multiphase flow behaviors. Langmuir, 2023, 39(34): 12226 12234.

Wang, F., Chang, S. Molecular dynamics investigation of shale oil occurrence and adsorption in nanopores: Unveiling wettability and influencing factors. Chemical Engineering Journal, 2024, 481: 148380.

Wang, S., Han, S., Sang, S., et al. Adsorption characteristics and storage models of subcritical/supercritical CO2 in coal seams. Natural Gas Industry Journal, 2024, 44(6): 152-168. (in Chinese)

Wang, Q., Xu, S., Xing, X., et al. Progress in fabrication and applications of micro/nanostructured superhydrophobic surfaces. Surface Innovations, 2021, 10(2): 89-110.

Wang, X., Zhang, Q. Role of surface roughness in the wettability, surface energy and flotation kinetics of calcite. Powder Technology, 2020, 371: 55-63.

Wenzel, R. N. Resistance of solid surfaces to wetting by water. Industrial & Engineering Chemistry, 1936, 28(8): 988-994.

Widom, B. Capillarity and wetting phenomena: Drops, bubbles, pearls, waves. Physics Today, 2004, 57(12): 66-67.

Wróblewski, P., Kachel, S. The concept of the contact angle in the process of oil film formation in internal combustion piston engines. Scientific Reports, 2023, 13(1): 20715.

Wu, J. Understanding the electric double-layer structure, capacitance, and charging dynamics. Chemical Reviews, 2022, 122(12): 10821-10859.

Xu, W., Fayaz-Torshizi, M., Müller, E. A. Effect of sur face roughness and morphology on the adsorption and transport of CH4/CO2 mixtures in nanoporous carbons. Journal of CO2 Utilization, 2024, 79: 102649.

Xu, R., Li, R., Ma, J., et al. Effect of mineral dissolution/precipitation and CO2 exsolution on CO2 transport in geo logical carbon storage. Accounts of Chemical Research, 2017, 50(9): 2056-2066.

Xu, C., Xue, H., Li, B., et al. Microscopic adsorption mechanism difference in the mineral pore of shale gas reservoir. Special Oil & Gas Reservoirs, 2020, 27(4): 80-84.

Xu, S., Zhou, S., Zhou, J., et al. Multiscale pore structure evolution of Longmaxi shale induced by acid treatment. Society of Petroleum Engineers Journal, 2023, 28(02): 831-844.

Yadav, A., Taha, A., Abdulsayed, Y. A., et al. A density functional theory (DFT) study on adsorption of a biological active ethionamide over the surface of a fe-decorated porphyrin system. Chemical Review and Letters, 2023, 6(2): 128-138.

Yan, Z., Wang, F., Liu, Y., et al. Dynamic wetting of a CO2 H2O-montmorillonite system using molecular dynamics. Fuel, 2024, 377: 132787.

Yang, Y., Liu, F., Yao, J., et al. Multi-scale reconstruction of porous media from low-resolution core images using conditional generative adversarial networks. Journal of Natural Gas Science and Engineering, 2022, 99: 104411.

Yang, Y., Narayanan Nair, A. K., Sun, S. Adsorption and diffusion of carbon dioxide, methane, and their mixture in carbon nanotubes in the presence of water. The Journal of Physical Chemistry C, 2020, 124(30): 16478-16487.

Yang, Y., Song, H., Imani, G., et al. Adsorption behavior of shale oil and water in the kerogen-kaolinite pore by molecular simulations. Journal of Molecular Liquids, 2024, 393: 123549.

Yang, X., Zhao, H., Qu, Z., et al. The effect of oxygen containing functional groups on formaldehyde adsorption in solution on carbon surface: A density functional theory study. Journal of Environmental Chemical Engineering, 2021, 9(5): 105987.

Yeon, J., Chowdhury, S. C., Gillespie Jr, J. W. Hydroxylation and water-surface interaction for S-glass and silica glass using ReaxFF based molecular dynamics simulations. Applied Surface Science, 2023, 608: 155078.

Yi, H., Jia, F., Zhao, Y., et al. Surface wettability of mont morillonite (0 0 1) surface as affected by surface charge and exchangeable cations: A molecular dynamic study. Applied Surface Science, 2018, 459: 148-154.

Young, T. III. An essay on the cohesion of fluids. Philosoph ical Transactions of the Royal Society of London, 1805, (95): 65-87.

Youngblood, J. P., McCarthy, T. J. Ultrahydrophobic polymer surfaces prepared by simultaneous ablation of polypropylene and sputtering of poly (tetrafluoroethylene) using radio frequency plasma. Macromolecules, 1999, 32(20): 6800-6806.

Yuan, J., Luo, D., Feng, L. A review of the technical and eco nomic evaluation techniques for shale gas development. Applied Energy, 2015, 148: 49-65.

Zhang, W., Feng, Q., Jin, Z., et al. Molecular simulation study of oil-water two-phase fluid transport in shale inorganic nanopores. Chemical Engineering Science, 2021, 245: 116948.

Zhang, J., Guo, B., Amponsah, V. N. B. A more rigorous mathematical model for capillary imbibition of CO2 in shale gas formations. Capillarity, 2025a, 14(3): 63-71.

Zhang, X., Guo, P., Gao, X., et al. Crack and failure behaviors of sandstone subjected to dynamic loads visualized by micro-computed tomography. Journal of Rock Mechanics and Geotechnical Engineering, 2025b, 17(3): 1459-1473.

Zhang, Y., Shi, L., Lan, L., et al. Interaction pattern of dense sandstone with CO2, and water. Science Technology and Engineering, 2025c, 25(3): 1028-1038. (in Chinese)

Zhang, S., Wang, T., Gao, Z., et al. Wettability controlling effects on the fluid occurrence and flow in shale gas reservoirs: Present problems and new sights. Capillarity, 2023, 9(2): 25-31.

Zhao, J. Fundamental and application research of CO2 and H2O competitive adsorption on carbon capture. Tianjin, Tianjin University, 2022. (in Chinese)

Zhao, J., Deng, S., Zhao, L., et al. Synergistic and competitive effect of H2O on CO2 adsorption capture: Mechanism explanations based on molecular dynamic simulation. Journal of CO2 Utilization, 2021, 52: 101662.

Zheng, Y., Huang, R., Yu, Y., et al. Synergistic effects of hydrophilic function group and micropores on water evaporation in a novel carbon hydrogels for efficient solar steam generation. Water Research, 2024, 257: 121707.

Zhou, J., Jin, Z., Luo, K. The role of brine in gas adsorption and dissolution in kerogen nanopores for enhanced gas recovery and CO2 sequestration. Chemical Engineering Journal, 2020, 399: 125704.


Refbacks

  • There are currently no refbacks.


Copyright (c) 2025 The Author(s)

Creative Commons License
This work is licensed under a Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International License.

Copyright ©2018. All Rights Reserved