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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
Authors:  Ma J(马俊);  Kang DL(康东亮);  Wang XH(王晓荷);  Zhao YP(赵亚溥)
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Kerogen maturity  Orbital hybridization  Machine learning  Quantum chemistry  
双层石墨烯层间限域CO氧化反应的密度泛函研究 期刊论文
物理学报, 2019, 卷号: 68, 期号: 21, 页码: 218101
Authors:  崔树稳;  李璐;  魏连甲;  钱萍
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石墨烯  限域反应  密度泛函理论  反应能垒  
Nanoindentation of thin graphdiyne films: Experiments and molecular dynamics simulation 期刊论文
CARBON, 2019, 卷号: 144, 页码: 72-80
Authors:  Xiao KL(肖凯璐);  Li JF;  Wu XQ(吴先前);  Liu HB;  Huang CG(黄晨光);  Li YL
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Analysis of dynamic decomposition for barium dimethyl-naphthalene-sulfonate on an Al3Mg (001) surface from ab-initio molecular dynamics 期刊论文
APPLIED SURFACE SCIENCE, 2019, 卷号: 466, 页码: 772-779
Authors:  Zhong J;  Li X;  欧阳文泽;  Tian Y
View  |  Adobe PDF(1274Kb)  |  Favorite  |  View/Download：87/17  |  Submit date：2019/04/11
ab-initio molecular dynamics  Barium dimethyl-naphthalene-sulfonate  The Al3Mg (001) surface  Dynamic decomposition  Design-of-experiment  
Life Science in Space: Experiments on Board the SJ-10 Recoverable Satellite 专著
Beijing；Singapore:Science Press; Springer, 2019
Authors:  Editors: Duan EK;  Long M(龙勉)
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d+id′ chiral superconductivity in bilayer silicene 期刊论文
PHYSICAL REVIEW LETTERS, 2013, 卷号: 111, 期号: 6, 页码: 066804/1-066804/5
Authors:  Liu F(刘峰);  Liu CC;  Wu KH;  Yang F;  Yao YG;  Liu, F (reprint author), Beijing Inst Technol, Sch Phys, Beijing 100081, Peoples R China.
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Effect of Al addition upon mechanical robustness and corrosion resistance of Mo5Si3/MoSi2 gradient nanocomposite coatings 期刊论文
SURFACE & COATINGS TECHNOLOGY, 2013, 卷号: 223, 期号: 25, 页码: 115-125
Authors:  Xu J;  Liu LL;  Li ZY(李正阳);  Munroe P;  Xie ZH;  Xu, J (reprint author), Nanjing Univ Aeronaut & Astronaut, Dept Mat Sci & Engn, 29 Yudao St, Nanjing 210016, Peoples R China
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Transition Metal Silicides  Corrosion Resistance  First-principle Calculation  Sputtered Films  
Negative differential resistance behavior of silicon monatomic chain encapsulated in carbon nanotubes 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2012, 卷号: 62, 页码: 87-92
Authors:  Zhang YY(张营营);  Wang FC(王奉超);  Zhao YP(赵亚溥);  Zhao, YP;  Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China.
Adobe PDF(1095Kb)  |  Favorite  |  View/Download：813/261  |  Submit date：2013/01/18
Silicon Monatomic Chain  Size-selective Encapsulation  Electronic Transport Properties  Negative Differential Resistance  Transmission Spectrum  Field-effect Transistors  Single  Nanowires  Simulations  
First principle study of the interaction and charge transfer between graphene and organic molecules 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2012, 卷号: 56, 页码: 79-84
Authors:  Chi M(迟美);  Zhao YP(赵亚溥);  Zhao, YP;  Chinese Acad Sci, Inst Mech, State Key Lab Nonlinear Mech, Beijing 100190, Peoples R China.
Adobe PDF(867Kb)  |  Favorite  |  View/Download：657/256  |  Submit date：2013/01/18
First Principle Study  Graphene  Organic Molecules  Adsorption  Epitaxial Graphene  Suspended Graphene  Gas  
Adsorption of formaldehyde molecule on the intrinsic and Al-doped graphene: a first principle study 期刊论文
Computational Materials Science, 2009, 卷号: 46, 期号: 4, 页码: 1085-1090
Authors:  Chi M(迟美);  Zhao YP(赵亚溥)
Adobe PDF(1053Kb)  |  Favorite  |  View/Download：965/302  |  Submit date：2009/12/28