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电场、应力和电荷态对Ti_2CO_2电子性质调控的理论研究 期刊论文
无机材料学报, 2020, 卷号: 35, 期号: 01, 页码: 73-80
Authors:  王昌英;  路宇畅;  任翠兰;  王刚;  怀平
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第一性原理  Ti2co2  电场  应力  电荷态  电子性质  
VaspCZ:一个提高效率的VASP计算辅助程序 期刊论文
核技术, 2020, 卷号: 43, 期号: 03, 页码: 34-40
Authors:  张正德;  谈蒙露;  任翠兰;  怀平
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第一性原理  VASP  辅助程序  电子结构计算  过渡态计算  
Elastic, mechanical, electronic, and defective properties of Zr-Al-C nanolaminates from first principles 期刊论文
JOURNAL OF THE AMERICAN CERAMIC SOCIETY, 2018, 卷号: 101, 期号: 2, 页码: 756-772
Authors:  Wang, CY;  Han, H;  Zhao, YY;  Zhang, W;  Guo, YL;  Ren, CL;  Zeng, GL;  Huang, Q;  Huai, P
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Crystal-structure  Max-phase  Layered Carbides  1st-principles  Zr3al3c5  Ti3sic2  Zr2al3c4  Temperature  Hf  Predictions  
Pressure-induced structural transformations and polymerization in ThC2 期刊论文
SCIENTIFIC REPORTS, 2017, 卷号: 7, 页码: -
Authors:  Guo, YL;  Yu, C;  Lin, J;  Wang, CY;  Ren, CL;  Sun, BX;  Huai, P;  Xie, RB;  Ke, XZ;  Zhu, ZY;  Xu, HJ
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内嵌金属的多壁碳纳米管辐射损伤研究 期刊论文
核技术, 2016, 卷号: v.39, 期号: 6, 页码: 81-86
Authors:  马佳文;  巩文斌;  张伟;  许子健;  王呈斌;  任翠兰;  怀平;  朱志远
View  |  Adobe PDF(319Kb)  |  Favorite  |  View/Download:203/31  |  Submit date:2016/12/21
辐射损伤  碳纳米管  分子动力学  核电池  
Development of a pair potential for Ni-He 期刊论文
JOURNAL OF NUCLEAR MATERIALS, 2016, 卷号: 472, 期号: -, 页码: 105—109
Authors:  Zhang, W;  Wang, CB;  Gong, HF;  Xu, ZJ;  Ren, CL;  Dai, JX;  Huai, P;  Zhu, ZY;  Deng, HQ;  Hu, WY;  Zhang, W (reprint author), Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai 201800, Peoples R China.
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Initio Molecular-dynamics  Total-energy Calculations  Wave Basis-set  Fe-he  Helium  Metals  Nickel  Iron  Simulations  Transition  
Effects of rare-earth on the cohesion of Ni Sigma 5 (012) grain boundary from first-principles calculations 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2015, 卷号: 96, 页码: 374—378
Authors:  Liu, WG;  Han, H;  Ren, CL;  Yin, HQ;  Zou, Y;  Huai, P;  Xu, HJ
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Alloys  Embrittlement  Segregation  Additions  Exchange  Impurity  Elements  
A molecular dynamics study of helium diffusion and clustering in fcc nickel 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2015, 卷号: 107, 页码: 54—57
Authors:  Wang, CB;  Ren, CL;  Zhang, W;  Gong, HF;  Huai, P;  Zhu, ZY;  Deng, HQ;  Hu, WY
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Principles Calculations  Bcc Iron  Metals  Tungsten  Potentials  Energies  Hydrogen  Defects  Bubbles  Surface  
Theoretical study of the interaction between metallic fission products and defective graphite 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2015, 卷号: 106, 页码: 129—134
Authors:  Xia, DQ;  Ren, CL;  Zhang, W;  Han, H;  Wang, CB;  Zhang, X;  Cheng, C;  Huai, P
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Minimum Energy Paths  Elastic Band Method  Saddle-points  Electron-gas  Graphene  1st-principles  
MOLECULAR DYNAMICS SIMULATION OF THE DISPLACEMENT CASCADES IN TUNGSTEN WITH INTERSTITIAL HELIUM ATOMS 期刊论文
FUSION SCIENCE AND TECHNOLOGY, 2014, 卷号: 66, 期号: 1, 页码: 112—117
Authors:  Yang, XD;  Deng, HQ;  Hu, NW;  Xiao, SF;  Ren, CL;  Huai, P;  Wang, CB;  Li, XF;  Hu, WY;  hqdeng@hnu.edu.cn
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Implanted Tungsten  Defect Production  Radiation-damage  Alpha-iron  Low-energy  Irradiation  Potentials  Surface  Model  He