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LiF-BeF_2熔盐微观结构及扩散特性的分子动力学研究 期刊论文
化工学报, 2020, 卷号: 71, 期号: 08, 页码: 3565-3574+3849
Authors:  贺国达;  汤睿;  段学志;  谢雷东;  傅杰;  戴建兴;  钱渊;  王建强
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Lif-bef2熔盐  分子模拟  微观结构  扩散  电导率  
First-principles investigation on the geometries, stabilities and defective properties of fluoride surfaces 期刊论文
COMPUTATIONAL MATERIALS SCIENCE, 2017, 卷号: 133, 页码: 159-166
Authors:  Han, H;  Yin, G;  Wang, H;  Wang, CY;  Shao, K;  Zhang, W;  Dai, JX;  Huai, P
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Metal Fluoride  First-principles  Surface Property  Density Functional Calculation  
A first-principles study on the defective properties of MAX phase Cr2AlC: the magnetic ordering and strong correlation effect 期刊论文
RSC ADVANCES, 2016, 卷号: 6, 期号: 87, 页码: 84262-84268
Authors:  Han, H;  Wickramaratne, D;  Huang, Q;  Dai, JX;  Li, TW;  Wang, H;  Zhang, W;  Huai, P;  Zhang, W (reprint author), Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai 201800, Peoples R China.;  Wang, H (reprint author), Henan Univ Sci & Technol, Sch Phys & Engn, Luoyang 471003, Peoples R China.
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First-principle investigation of the structure and vibrational spectra of the local structures in LiF-BeF2 Molten Salts 期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2016, 卷号: 213, 期号: -, 页码: 17—22
Authors:  Dai, JX;  Han, H;  Li, QN;  Huai, P;  Huai, P (reprint author), Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai 201800, Peoples R China.
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Initio Molecular-dynamics  Space Gaussian Pseudopotentials  Infrared-spectrum  Liquid Water  Protonated Peptides  Raman-spectra  Spectroscopy  Simulations  Density  Mixtures  
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  
Molecular dynamics studies of the structure of pure molten ThF4 and ThF4-LiF-BeF2 melts 期刊论文
JOURNAL OF MOLECULAR LIQUIDS, 2015, 卷号: 211, 页码: 747—753
Authors:  Dai, JX;  Long, DW;  Huai, P;  Li, QNA;  Huai, P (reprint author), Chinese Acad Sci, Shanghai Inst Appl Phys, Shanghai 201800, Peoples R China.
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Fluoride Complex-ions  Raman-spectra  1st-principles Description  Salt Reactor  Liquid Bef2  Mixtures  Lif  Simulation  Chlorides  Lif-bef2  
反应器及包括其的反应系统 专利
专利类型: 实用新型, 专利号: CN203075934, 申请日期: 2013-01-29,
Authors:  周金豪;  张焕琦;  程治强;  李杨娟;  戴建兴;  李晴暖;  吴国忠
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反应器及包括其的反应系统和其内衬的制造方法 专利
专利类型: 发明, 专利号: CN103143308, 申请日期: 2013-01-29,
Authors:  周金豪;  张焕琦;  程治强;  李杨娟;  戴建兴;  李晴暖;  吴国忠
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铀化合物与不同氟化剂反应的高温热力学 期刊论文
核技术, 2012, 期号: 9, 页码: 704-708
Authors:  戴建兴;  张焕琦;  李晴暖;  吴国忠
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