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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  
基于第一原理计算拟合Ag、Si和C原子间作用势的研究 期刊论文
华东师范大学学报(自然科学版), 2017, 期号: 4, 页码: "114-125"
Authors:  王永伟;  郭永亮;  张伟;  柯学志
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Tersoff势  力匹配  Sic  第一性原理计算  
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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Structural Phase Transition of ThC Under High Pressure 期刊论文
SCIENTIFIC REPORTS, 2017, 卷号: 7, 页码: -
Authors:  Yu, C;  Lin, J;  Huai, P;  Guo, YL;  Ke, XZ;  Yu, XH;  Yang, K;  Li, NN;  Yang, WG;  Sun, BX;  Xie, RB;  Xu, HJ
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Structural and electronic phase transitions of ThS2 from first-principles calculations 期刊论文
PHYSICAL REVIEW B, 2016, 卷号: 94, 期号: 13, 页码: -
Authors:  Guo, YL;  Wang, CY;  Qiu, WJ;  Ke, XZ;  Huai, P;  Cheng, C;  Zhu, ZY;  Chen, CF;  Ke, XZ (reprint author), East China Normal Univ, Inst Theoret Phys, Dept Phys, Shanghai 200241, Peoples R China.
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