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Density Functional Theory Calculations of Equilibrium Mo Isotope Fractionation Factors among MoOxS4-x2- Species in the Aqueous Phase by the ONIOM Method 期刊论文
ACS EARTH AND SPACE CHEMISTRY, 2022, 页码: 14./通讯作者：He, Yuyang
作者:  He YY(何雨旸);  Gao,Caihong;  Wei,Wei;  Liu,Yun
Adobe PDF(3228Kb)  |  收藏  |  浏览/下载：580/334  |  提交时间：2023/02/03
paleoredox proxy  ab initio molecular dynamics  implicit solvent model  dispersion correction  water-droplet  periodical boundary condition  
Intrinsic sodium occurrence in Zhundong coal: Experimental observations and molecular modeling 期刊论文
FUEL, 2021, 卷号: 305, 页码: 12./通讯作者：Wei, Xiaolin
作者:  Sun C(孙岑);  Wei XL(魏小林);  Kang RN(康润宁);  Bin F(宾峰);  Li S(李森)
Adobe PDF(9737Kb)  |  收藏  |  浏览/下载：441/114  |  提交时间：2021/11/01
Alkali metal occurrence model  Zhundong coal  Molecular model  DFT  NMR  
Hydrodynamic Properties of Polymers Screening the Electrokinetic Flow: Insights from a Computational Study 期刊论文
POLYMERS, 2019, 卷号: 11, 期号: 6, 页码: 13./通讯作者：Wu, Peng
作者:  Wu P;  Sun T;  Jiang XK(蒋玺恺);  Kondrat S
浏览  |  Adobe PDF(858Kb)  |  收藏  |  浏览/下载：322/123  |  提交时间：2019/09/09
polymeric coatings  Stokes radius  hydrodynamic shielding  molecular dynamics simulations  Navier-Stokes-Brinkman model  
Graphene Foam: Uniaxial Tension Behavior and Fracture Mode Based on a Mesoscopic Model 期刊论文
ACS NANO, 2017, 卷号: 11, 期号: 9, 页码: 8988-8997
作者:  Pan DX(潘斗兴);  Wang C(王超);  Wang ZQ(王自强);  Yao YG(姚裕贵);  Yao, YG (reprint author), Beijing Inst Technol, Sch Phys, Beijing Key Lab Nanophoton & Ultrafine Optoelect, Beijing 100081, Peoples R China.;  Wang, TC (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China.
浏览  |  Adobe PDF(318Kb)  |  收藏  |  浏览/下载：524/190  |  提交时间：2017/11/29
Mesoscopic Model  Graphene Foam  Coarse-grained Molecular Dynamics  Multipeak Stress Strain Curve  Ductile Fracture  Power Scaling Law  Multiscale Physics Mechanics  
Transition of mechanisms underlying the rate effects and its significance 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2015, 卷号: 98, 页码: 70-75
作者:  Xiao P(肖攀);  Wang J(王军);  Yang R(杨荣);  Ke FJ(柯孚久);  Bai YL(白以龙);  Xiao, P (reprint author), Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China.
浏览  |  Adobe PDF(1741Kb)  |  收藏  |  浏览/下载：311/104  |  提交时间：2015/03/17
Strain Rate Effect  Molecular Dynamics  Thermal Activation Model  Potential Landscapes  
A stochastic description on the traction-separation law of an interface with non-covalent bonding 期刊论文
JOURNAL OF THE MECHANICS AND PHYSICS OF SOLIDS, 2014, 卷号: 70, 页码: 227-241
作者:  Wei YJ(魏宇杰);  Wei, YJ (reprint author), Chinese Acad Sci, Inst Mech, LNM, Beijing 100190, Peoples R China.
浏览  |  Adobe PDF(721Kb)  |  收藏  |  浏览/下载：806/185  |  提交时间：2014/11/03
Fatigue-crack Growth  Cohesive Zone Model  Cell-adhesion  Numerical-simulation  Mechanical Model  Brownian-motion  Molecular-bond  Elastic Solids  Force  Resistance  
Moving contact line problem: Advances and perspectives 期刊论文
Theoretical & Applied Mechanics Letters, 2014, 期号: 3, 页码: 7-23+6
作者:  Zhao YP(赵亚溥)
浏览  |  Adobe PDF(1530Kb)  |  收藏  |  浏览/下载：1471/1016  |  提交时间：2015/09/02
Solid–liquid Interface  Moving Contact Line  Huh–scriven Paradox  Molecular Kinetic Theory  Electrowetting  Electro-elasto-capillarity  Slip Boundary Conditions  Cell Spreading  Zhurkov–bell Model  Emergent Phenomenon  
Cellular entry of graphene nanosheets: The role of thickness, oxidation and surface adsorption 期刊论文
RSC ADVANCES, 2013, 卷号: 3, 期号: 36, 页码: 15776-15782
作者:  Wang JL(王九令);  Wei YJ(魏宇杰);  Shi XH(施兴华);  Gao HJ;  Shi, XH (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China.
Adobe PDF(1262Kb)  |  收藏  |  浏览/下载：1266/319  |  提交时间：2013/09/27
Carbon Nanotubes  Graphene Nanosheets  Lipid-bilayers  Coarse-grained Model  Molecular-dynamics  Hydrophobicity  Surface Absorption  Oxidation  Bio Medical Diagnosticscarbon Nanotubes  Graphene Nanosheets  Lipid-bilayers  Coarse-grained Model  Molecular-dynamics  Hydrophobicity  Surface Absorption  Oxidation  Bio Medical Diagnostics  
Fundamentals and applications of electrowetting: A critical review 期刊论文
REVIEWS OF ADHESION AND ADHESIVES, 2013, 卷号: 1, 期号: 1, 页码: 114-174
作者:  Zhao YP(赵亚溥);  Wang Y(王樱)
Adobe PDF(3364Kb)  |  收藏  |  浏览/下载：1397/492  |  提交时间：2014/02/13
Electrowetting (Ew)  Electrowetting-on-dielectric (Ewod)  Lippmann-young (L-y) Equation  Curvature Effect  Elasto-electro-capillarity (Eec)  Lattice Boltzmann Method (Lbm)  Phase-field Model  Molecular Dynamics (Md) Simulations  Coffee Stain Ring  Electronic Display  Liquid Lens  Micro Total Analysis Systems (Μ-tas)  Cell-based Digital Microfluidics  
A diffusion and curvature dependent surface elastic model with application to stress analysis of anode in lithium ion battery 期刊论文
INTERNATIONAL JOURNAL OF ENGINEERING SCIENCE, 2012, 卷号: 61, 页码: 156-170
作者:  Zang JL(臧金良);  Zhao YP(赵亚溥);  Zhao, YP;  Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China.
Adobe PDF(1292Kb)  |  收藏  |  浏览/下载：1316/333  |  提交时间：2013/01/18
Surface Elastic Model  Tolman Length  Lithium Ion Battery  Nanostructured Si Electrode  Pulverization  Molecular-dynamics  Linear-theory  Silicon  Electrodes  Account  Solids  Energy  Shells