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High-Throughput Screening of Nitrogen-Coordinated Bimetal Catalysts for Multielectron Reduction of CO2 to CH4 with High Selectivity and Low Limiting Potential 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2021, 卷号: 125, 期号: 13, 页码: 7155-7165
作者:  Wang Shuo;  Li Lei;  Li Jing;  Yuan Chengzong;  Kang Yao;  Hui Kwan San;  Zhang Jintao;  Bin F(宾峰);  Fan Xi;  Chen Fuming;  Hui Kwun Nam
Adobe PDF(6747Kb)  |  收藏  |  浏览/下载:395/122  |  提交时间:2021/05/17
Reaction Mechanism of the Aluminum Nanoparticle: Physicochemical Reaction and Heat/Mass Transfer 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY C, 2020, 卷号: 124, 期号: 6, 页码: 3886-3894
作者:  Chu QZ;  Shi BL;  Liao LJ(廖丽涓);  Zou XR;  Luo KH;  Wang NF
Adobe PDF(4138Kb)  |  收藏  |  浏览/下载:336/173  |  提交时间:2020/05/18
First principles study of magnetism induced by topological frustration of bowtie-shaped graphene nanoflake 期刊论文
CARBON, 2018, 卷号: 127, 页码: 432-436
作者:  Ge Y;  Ji JL;  Shen ZZ;  Zhang Q;  Jian AQ;  Duan QQ;  Wang C(王超);  Jiang J;  Zhang WD;  Sang SB
浏览  |  Adobe PDF(1171Kb)  |  收藏  |  浏览/下载:300/114  |  提交时间:2018/02/08
Molecular dynamics simulation of an argon cluster filled inside carbon nanotubes 期刊论文
Chinese Physics B, 2014, 卷号: 23, 期号: 10, 页码: 106105
作者:  Cui SW(崔树稳);  Zhu RC(朱如曾);  Wang XS;  Yang HX;  Zhu, RZ (reprint author), Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech LNM, Beijing 100190, Peoples R China.
浏览  |  Adobe PDF(1748Kb)  |  收藏  |  浏览/下载:591/115  |  提交时间:2014/11/27
Carbon Nanotubes  Argon Cluster  Molecular Dynamics Simulation  
Atomistic simulation study on the tensile deformation behaviour ofnanocrystalline Ni 会议论文
Chinese Materials Congress 2012, CMC 2012, Taiyuan, China, JUL 13-18, 2012
作者:  Li WB(李文彬);  Yuan FP(袁福平);  Wu XL(武晓雷);  Li WB(李文彬)
浏览  |  Adobe PDF(1247Kb)  |  收藏  |  浏览/下载:482/154  |  提交时间:2014/02/24
金属纳米材料若干强韧问题的机理研究 学位论文
博士论文,北京: 中国科学院研究生院, 2013
作者:  魏豪杰
Adobe PDF(7278Kb)  |  收藏  |  浏览/下载:479/11  |  提交时间:2014/01/13
纳米金属塑性行为的分子动力学模拟 学位论文
硕士论文,北京: 中国科学院研究生院, 2013
作者:  李文彬
Adobe PDF(7924Kb)  |  收藏  |  浏览/下载:269/10  |  提交时间:2014/01/13
Understanding formation mechanism of ZnO diatomic chain and multi-shell structure using physical mechanics: Molecular dynamics and first-principle simulations 期刊论文
SCIENCE CHINA-PHYSICS MECHANICS & ASTRONOMY, 2012, 卷号: 55, 期号: 6, 页码: 1138-1146
作者:  Wang BB(王斌斌);  Wang FC(王奉超);  Zhao YP(赵亚溥);  Zhao, YP
浏览  |  Adobe PDF(1220Kb)  |  收藏  |  浏览/下载:976/321  |  提交时间:2013/01/18
Diatomic Chain  Multi-shell Structure  Zno  Size Effect  Temperature And Strain Rate Effects  Monoatomic Nanowires  Gold Nanowires  Break  Conductance  Junctions  Atoms  Ag  
Atomistic Simulation Study on the Tensile Deformation Behaviour of Nanocrystalline Ni 会议论文
中国材料大会2012, 中国山西太原, 2012-07-13
作者:  Li WB(李文彬);  Yuan FP(袁福平);  Wu XL(武晓雷)
浏览  |  Adobe PDF(826Kb)  |  收藏  |  浏览/下载:219/74  |  提交时间:2015/09/09
Nanocrystalline Materials  Molecular Dynamics Simulations  Plastic Deformation  Stress States