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[期刊论文] 作者:CHENG Yan,LU Lai-Yu,JIA Ou-He,, 来源:理论物理通讯:英文版 年份:2008
转变阶段和到 CsCl 结构(B2 ) 的从 NaCl 结构(B1 ) 的 SrS 的有弹性的性质被 ab initio 飞机波浪调查假潜在的密度功能的理论方法并且由伪泛音 Debye 模型。转变压力与温度...
[期刊论文] 作者:Lu Lai-Yu,Chen Xiang-Rong,Yu Bai-Ru,Gou Qing-Quan, 来源:中国物理(英文版) 年份:2006
The transition phase of GaAs from the zincblende (ZB) structure to the rocksalt (RS) structure is investigated by ab initio plane-wave pseudopotential density f...
[期刊论文] 作者:Cheng Yan,Lu Lai-Yu,Jia Ou-He,Chen Xiang-Rong, 来源:中国物理B(英文版) 年份:2008
The phase transition of SrS from NaG1 structure (B1) to CsCl structure (B2) is investigated by means of ab initio plane-wave pseudopotential density functional...
[期刊论文] 作者:LU Lai-Yu,WEI Dong-Qing,CHEN Xiang-Rong,JI Guang-Fu, 来源:中国物理快报(英文版) 年份:2008
Structures and electronic properties of the pentaerythritol (PE) crystal under volume compression up to 0.85Vo are studied by E - V fitting method using density...
[期刊论文] 作者:Liu Zi-Jiang,Cheng Xin-Lu,Chen Xiang-Rong,Zhang Hong,Lu Lai-Yu, 来源:中国物理(英文版) 年份:2004
The P-V-T equation of state of MgO has been simulated under high pressure and elevated temperature using the molecular dynamics (MD) method with the breathing s...
[期刊论文] 作者:LIAN Dan,LU Lai-Yu,WEI Dong-Qing,ZHANG Qing-Ming,GONG Zi-Zheng,GUO Yong-Xin, 来源:中国物理快报(英文版) 年份:2008
Density functional theory (DFT) with local density approximation (LDA) is employed to study the structural and electronic properties of the high explosive octah...
[期刊论文] 作者:ZHANG Bi-Xing(张碧星),LU Lai-Yu(鲁来玉),WANG Cheng-Hao(汪承灏), 来源:中国物理快报(英文版) 年份:2004
Inversion of Rayleigh waves is studied for the first time by using the genetic algorithm based on the intensities of the fundamental and/or higher modes. The re...
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