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Defining kerogen maturity from orbital hybridization by machine learning 期刊论文
FUEL, 2022, 卷号: 310, 页码: 10
作者:  Ma J(马俊);  Kang DL(康东亮);  Wang XH(王晓荷);  Zhao YP(赵亚溥)
Adobe PDF(4071Kb)  |  收藏  |  浏览/下载：288/62  |  提交时间：2021/11/29
Kerogen maturity  Orbital hybridization  Machine learning  Quantum chemistry  
Peeling of graphene/molybdenum disulfide heterostructure at different angles: A continuum model with accommodations for van der Waals interaction 期刊论文
COMPOSITES PART A-APPLIED SCIENCE AND MANUFACTURING, 2021, 卷号: 150, 页码: 11
作者:  Wei ZX(魏子雄);  Lin K(林岿);  Wang XH(王晓荷);  Zhao YP(赵亚溥)
Adobe PDF(3848Kb)  |  收藏  |  浏览/下载：310/89  |  提交时间：2021/11/01
A  Layered structures  B  Adhesion  C  Analytical modelling  C  Computational modelling  
Predicting the components and types of kerogen in shale by combining machine learning with NMR spectra 期刊论文
FUEL, 2021, 卷号: 290, 页码: 10
作者:  Kang DL(康东亮);  Wang XH(王晓荷);  Zheng XJ(郑晓娇);  Zhao YP(赵亚溥)
Adobe PDF(5174Kb)  |  收藏  |  浏览/下载：392/141  |  提交时间：2021/03/30
Machine learning  Kerogen and shale  Molecular structure  High-throughput prediction  NMR spectra datasets  
The time-temperature-maturity relationship: A chemical kinetic model of kerogen evolution based on a developed molecule-maturity index 期刊论文
FUEL, 2020, 卷号: 278, 页码: 14
作者:  Wang XH(王晓荷);  Zhao YP(赵亚溥)
Adobe PDF(7931Kb)  |  收藏  |  浏览/下载：358/133  |  提交时间：2020/09/27
Kerogen thermal evolution  Kerogen maturity index  Vitrinite reflectance  Chemical kinetic model  Activation energy  
Adsorption-induced pore blocking and its mechanisms in nanoporous shale due to interactions with supercritical CO2 期刊论文
JOURNAL OF PETROLEUM SCIENCE AND ENGINEERING, 2019, 卷号: 178, 页码: 74-81
作者:  Huang XF(黄先富);  Zhao YP(赵亚溥);  Wang XH(王晓荷);  Pan LS(潘利生)
浏览  |  Adobe PDF(2966Kb)  |  收藏  |  浏览/下载：635/163  |  提交时间：2019/06/10
Shale oil and gas  CO2 sequestration  Swelling  Chemical reaction  Nitrogen adsorption isotherm  XPS  
Mechanical peeling of van der Waals heterostructures: Theory and simulations 期刊论文
EXTREME MECHANICS LETTERS, 2019, 卷号: 30, 页码: 11
作者:  Lin H(林慧);  Zhao YP(赵亚溥)
浏览  |  Adobe PDF(4323Kb)  |  收藏  |  浏览/下载：379/173  |  提交时间：2019/09/09
van der Waals heterostructures  Mechanical peeling  Density functional theory  Molecular dynamics simulation  Elasto-peeling length  
The Constructions and Pyrolysis of 3D Kerogen Macromolecular Models: Experiments and Simulations 期刊论文
GLOBAL CHALLENGES, 2019, 卷号: 3, 期号: 5, 页码: 1900006
作者:  Wang XH(王晓荷);  Huang XF(黄先富);  Lin K(林岿);  Zhao YP(赵亚溥)
浏览  |  Adobe PDF(4817Kb)  |  收藏  |  浏览/下载：218/72  |  提交时间：2020/03/21
chemical kinetics  hybrid MD  fbMC approach  kerogen  macromolecular models  pyrolysis  
The Constructions and Pyrolysis of 3D Kerogen Macromolecular Models: Experiments and Simulations 期刊论文
GLOBAL CHALLENGES, 2019, 卷号: 3, 期号: 5, 页码: 1900006
作者:  Wang XH(王晓荷);  Huang XF(黄先富);  Lin K(林岿);  Zhao YP(赵亚溥)
浏览  |  Adobe PDF(4817Kb)  |  收藏  |  浏览/下载：239/94  |  提交时间：2020/03/21
chemical kinetics  hybrid MD  fbMC approach  kerogen  macromolecular models  pyrolysis  
Using graphene to simplify the adsorption of methane on shale in MD simulations 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2017, 卷号: 133, 页码: 99-107
作者:  Lin K;  Yuan QZ(袁泉子);  Zhao YP(赵亚溥);  Zhao, YP (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China.
浏览  |  Adobe PDF(2550Kb)  |  收藏  |  浏览/下载：525/219  |  提交时间：2017/07/24
Graphene  Shale  Adsorption Isotherms  Adsorption Heat  Simulations  
Molecular Dynamics Simulation of Self-Aggregation of Asphaltenes at an Oil/Water Interface: Formation and Destruction of the Asphaltene Protective Film 期刊论文
ENERGY & FUELS, 2014, 卷号: 29, 期号: 2, 页码: 1233-1242
作者:  Liu J;  Zhao YP(赵亚溥);  Ren SL;  Ren, SL (reprint author), Chinese Acad Sci, Lanzhou Inst Chem Phys, State Key Lab Solid Lubricat, Lanzhou 730000, Peoples R China.
浏览  |  Adobe PDF(6252Kb)  |  收藏  |  浏览/下载：599/252  |  提交时间：2015/04/28