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Influence of integration formulations on the performance of the fast inertial relaxation engine (FIRE) method 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2019, 卷号: 156, 页码: 135-141
作者:  Shuang F(双飞);  Xiao P(肖攀);  Shi RH;  Ke FJ(柯孚久);  Bai YL(白以龙)
Adobe PDF(5768Kb)  |  收藏  |  浏览/下载：549/95  |  提交时间：2019/04/11
Energy minimization  Fast inertial relaxation engine method  Integration formulations  Molecular simulations  
Efficiency and fidelity of molecular simulations relevant to dislocation evolutions 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2017, 卷号: 139, 页码: 266-272
作者:  Shuang F(双飞);  Xiao P(肖攀);  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.
Adobe PDF(1760Kb)  |  收藏  |  浏览/下载：327/99  |  提交时间：2017/11/29
Molecular Dynamics  Energy Minimization  Dislocation Evolution  Computational Efficiency  
Deformation-induced blueshift in emission spectrum of CdTe quantum dot composites 期刊论文
COMPOSITES PART B-ENGINEERING, 2017, 卷号: 120, 页码: 54-62
作者:  Xiao P(肖攀);  Ke FJ(柯孚久);  Bai YL(白以龙);  Zhou M;  Zhou, M (reprint author), Georgia Inst Technol, George W Woodruff Sch Mech Engn, Sch Mat Sci & Engn, Atlanta, GA 30332 USA.
浏览  |  Adobe PDF(2771Kb)  |  收藏  |  浏览/下载：362/126  |  提交时间：2017/07/24
Cdte Quantum Dot  Band Gap  Empirical Tight Binding  Molecular Dynamics  Finite Element Method  Pressure Sensor  Laser-driven Shock Compression  
Effects of oxygen vacancies on polarization stability of barium titanate 期刊论文
SCIENCE CHINA-PHYSICS MECHANICS & ASTRONOMY, 2016, 卷号: 59, 期号: 3, 页码: 634602
作者:  Wang J(王军);  Shen YG;  Song F(宋凡);  Ke FJ(柯孚久);  Bai YL(白以龙);  Lu CS;  Ke, FJ (reprint author), Beihang Univ, Sch Phys & Nucl Energy Engn, Beijing 100191, Peoples R China.
浏览  |  Adobe PDF(1418Kb)  |  收藏  |  浏览/下载：504/213  |  提交时间：2016/03/21
Ferroelectricity  Hysteresis  Oxygen Vacancy  Molecular Dynamics Simulation  
Size-dependent brittle-to-ductile transition in GaAs nano-rods 期刊论文
ENGINEERING FRACTURE MECHANICS, 2015, 卷号: 150, 页码: 135-142
作者:  Wang J(王军);  Shen YG;  Song F(宋凡);  Ke FJ(柯孚久);  Bai YL(白以龙);  Lu C;  Lu, C (reprint author), Curtin Univ, Dept Mech Engn, Perth, WA 6845, Australia.
浏览  |  Adobe PDF(1705Kb)  |  收藏  |  浏览/下载：361/118  |  提交时间：2016/01/08
Molecular Dynamics Simulation  Gaas Nano-rods  Brittle-to-ductile Transition  Dislocation  Size Effect  
Rate effect and coupled evolution of atomic motions and potential landscapes 期刊论文
ACTA MECHANICA SINICA, 2013, 卷号: 29, 期号: 5, 页码: 676-681
作者:  Xiao P(肖攀);  Wang J(王军);  Yang R(杨荣);  Ke FJ(柯孚久);  Xia MF(夏蒙棼);  Bai YL(白以龙);  Bai, YL (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech LNM, Beijing 100190, Peoples R China.
Adobe PDF(387Kb)  |  收藏  |  浏览/下载：808/231  |  提交时间：2013/11/06
Strain Rate Effect  Atomic Motions  Potential Landscape  Molecular Simulation  
Self-healing in fractured GaAs nanowires 期刊论文
Acta Materialia, 2012, 卷号: 60, 期号: 15, 页码: 5593-5600
作者:  Wang J(王军);  Lu CS(卢春生);  Wang Q;  Xiao P(肖攀);  Ke FJ(柯孚久);  Bai YL(白以龙);  Shen YG;  Wang YB;  Chen B;  Liao XZ;  Gao HJ;  Lu, CS;  Curtin Univ Technol, Dept Mech Engn, Perth, WA 6845, Australia.
Adobe PDF(2522Kb)  |  收藏  |  浏览/下载：1229/351  |  提交时间：2013/01/18
Gaas Nanowires  Self-healing  Size Effect  Multiple Healing  Molecular Dynamics  Resolution Electron-microscopy  Zinc-oxide Nanocrystallites  Ambient-temperature  Molecular-dynamics  Gold Nanowires  Zno Nanowires  Polymers  Behavior  Size  
Influence of microstructures on mechanical behaviours of SiC nanowires: a molecular dynamics study 期刊论文
NANOTECHNOLOGY, 2012, 卷号: 23, 期号: 2, 页码: 025703
作者:  Wang J(王军);  Lu CS(卢春生);  Wang Q;  Xiao P(肖攀);  Ke FJ(柯孚久);  Bai YL(白以龙);  Shen YG;  Liao XZ;  Gao HJ(高华健)
Adobe PDF(2723Kb)  |  收藏  |  浏览/下载：1475/460  |  提交时间：2013/01/04
Nanowire  Sic  Microstructure  Mechanical Behaviour  Molecular Dynamic  Behaviour  Mechanical  Dynamic  Formula See  Molecular  Intergranular  Influence  See Text  Grain  Brittleness  
Molecular statistical thermodynamics - A distinct and efficient numerical approach to quasi-static analysis of nanomaterials at finite temperature 期刊论文
Composites Part B-Engineering, 2012, 卷号: 43, 期号: 1, 页码: 57-63
作者:  Xiao P(肖攀);  Wang J(王军);  Ke FJ(柯孚久);  Bai YL(白以龙)
Adobe PDF(1262Kb)  |  收藏  |  浏览/下载：953/276  |  提交时间：2012/12/04
Free-energy-minimization  Elastic Properties  Size  Defects  Solids  Nanowires  Mechanics  Nano-structures  Mechanical Properties  Computational Modeling  Micro-mechanics  
SELF-ADAPTIVE MOLECULE/CLUSTER STATISTICAL THERMODYNAMICS METHOD FOR QUASI-STATIC DEFORMATION AT FINITE TEMPERATURE 期刊论文
Acta Mechanica Solida Sinica, 2011, 卷号: 24, 期号: 1, 页码: 92-100
作者:  Tan H(谭浩);  Wang HY(汪海英);  Xia MF(夏蒙棼);  Ke FJ(柯孚久);  Bai YL(白以龙);  Wang, HY (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech LNM, Beijing 100190, Peoples R China
Adobe PDF(900Kb)  |  收藏  |  浏览/下载：914/223  |  提交时间：2012/04/01
Self-adaptive  Slip Shear Deformation  Particle Method Approximation  Refinement Criterion  Switching Criterion  Free-energy-minimization  Molecular-dynamics  Continuum Models  Element  Solids