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Interactions between typical functional groups of soil organic matter and mica (001) surface: A DFT study 期刊论文
APPLIED CLAY SCIENCE, 2022, 卷号: 216, 页码: 106374
Authors:  Zhang, Hongping;  Chen, Meng;  Sun, Chenghua;  Tang, Youhong;  Ni, Yuxiang;  Dong, Faqin
Favorite  |  View/Download：17/0  |  Submit date：2023/09/18
SO2 adsorption and conversion on pristine and defected calcite {104} surface: A density functional theory study 期刊论文
APPLIED SURFACE SCIENCE, 2022, 卷号: 596, 页码: 153575
Authors:  Zhang, Hongping;  Zhang, Run;  Ni, Yuxiang;  Chen, Meng;  Sun, Chenghua;  Dong, Faqin
Favorite  |  View/Download：14/0  |  Submit date：2023/09/18
Effect of Cations (Na+, K+, and Ca2+) on Methane Hydrate Formation on the External Surface of Montmorillonite: Insights from Molecular Dynamics Simulation 期刊论文
ACS EARTH AND SPACE CHEMISTRY, 2020, 卷号: 4, 期号: 4, 页码: 572-582
Authors:  Li, Yun;  Chen, Meng;  Song, Hongzhe;  Yuan, Peng;  Zhang, Baifa;  Liu, Dong;  Zhou, Huijun;  Bu, Hongling
Adobe PDF(8775Kb)  |  Favorite  |  View/Download：96/0  |  Submit date：2021/11/19
Effects of Layer-Charge Distribution of 2:1 Clay Minerals on Methane Hydrate Formation: A Molecular Dynamics Simulation Study 期刊论文
LANGMUIR, 2020, 卷号: 36, 期号: 13, 页码: 3323-3335
Authors:  Li, Yun;  Chen, Meng;  Liu, Chanjuan;  Song, Hongzhe;  Yuan, Peng;  Zhang, Baifa;  Liu, Dong;  Du, Peixin
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Methane hydrate formation in the stacking of kaolinite particles with different surface contacts as nanoreactors: A molecular dynamics simulation study 期刊论文
APPLIED CLAY SCIENCE, 2020, 卷号: 186, 页码: 10
Authors:  Li, Yun;  Chen, Meng;  Song, Hongzhe;  Yuan, Peng;  Liu, Dong;  Zhang, Baifa;  Bu, Hongling
Adobe PDF(5477Kb)  |  Favorite  |  View/Download：72/0  |  Submit date：2021/11/19
Regulating the effect of element doping on the CO2 capture performance of kaolinite: A density functional theory study 期刊论文
APPLIED SURFACE SCIENCE, 2020, 卷号: 512, 页码: 145642
Authors:  Hou, Jialiang;  Chen, Meng;  Zhou, Yanfang;  Bian, Liang;  Dong, Faqing;  Tang, Youhong;  Ni, Yuxiang;  Zhang, Hongping
Favorite  |  View/Download：85/0  |  Submit date：2021/11/10