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[期刊论文] 作者:FU Zhi-Jian,JI Guang-Fu,CHEN X,
来源:理论物理通讯:英文版 年份:2009
有弹性的常数和钻石的热力学的性质被使用 CRYSTAL03 节目调查。格子参数,体积模量,热能力, Gr ü n eisen 参数,和 Debye 温度被获得。结果在对可得到的试验性、理论的数据...
[期刊论文] 作者:Zhang Liang,Ji Guang-Fu,Zhao Feng,Gong Zi-Zheng,
来源:中国物理B(英文版) 年份:2011
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,First-principles study of mechanical stability and thermal properties of MNNi3 (M=Zn, Mg, Al) under
[期刊论文] 作者:Zhai Hong-Cun,Li Xiao-Feng,Du Jun-Yi,Ji Guang-Fu,
来源:中国物理B(英文版) 年份:2012
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[期刊论文] 作者:Luo Fen,Fu Min,Ji Guang-Fu,Chen Xiang-Rong,
来源:中国物理B(英文版) 年份:2010
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[期刊论文] 作者:Yu Jing-Xin,Fu Min,Ji Guang-Fu,Chen Xiang-Rong,
来源:中国物理B(英文版) 年份:2009
The pressure induced phase transitions of TiO2 from anatase to columbite structure and from rutile to columbite structure and the temperature induced phase tran...
[期刊论文] 作者:Ju Yuan-Yuan,Zhang Qing-Ming,Gong Zi-Zheng,Ji Guang-Fu,
来源:中国物理B(英文版) 年份:2013
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,First-Principles Calculations of Structures and Electronic Properties of Solid Pentaerythritol unde
[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:CUI Hong-Ling,CHEN Xiang-Rong,JI Guang-Fu,WEI Dong-Qing,
来源:中国物理快报(英文版) 年份:2008
A first-principles plane wave method with the ultrasoft pseudopotential scheme in the frame of the density functional theory (DFT) is performed to calculate the...
[期刊论文] 作者:LI Xiao-Feng,CHEN Xiang-Rong,JI Guang-Fu,MENG Chuan-Min,
来源:中国物理快报(英文版) 年份:2006
We investigate the equilibrium lattice constant, bulk modulus, elastic constants and Debye temperature of Li2 O under pressure by using ab initio unrestricted H...
,Structural and Thermodynamic Properties of Cerium via First-Principles Plane Wave Method with a Rel
[期刊论文] 作者:SUN Li-Li,JI Guang-Fu,CHEN Xiang-Rong,GOU Qing-Quan,
来源:中国物理快报(英文版) 年份:2009
We investigate the structural and thermodynamic properties of cerium in a phase by using the first-principles plane wave method with a relativistic analytic pse...
[期刊论文] 作者:LUO Fen,CHENG Yan,JI Guang-Fu,CHEN Xiang-Rong,
来源:中国物理快报(英文版) 年份:2009
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[期刊论文] 作者:Li Xiao-Feng,Zhai Hong-Cun,Fu Hong-Zhi,Liu Zhong-Li,Ji Guang-Fu,
来源:中国物理B(英文版) 年份:2011
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[期刊论文] 作者:YU Liu-Min,SHI Guo-Sheng,WANG Zhi-Gang,JI Guang-Fu,LU Zhi-Peng,
来源:中国物理快报(英文版) 年份:2009
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,First-Principles Study of Orthorhombic Perovskites MgSiO3 up to 120GPa and Its Geophysical Implicat
[期刊论文] 作者:DENG Li-Wei,ZHAO Ji-Jun,JI Guang-Fu,GONG Zi-Zheng,WEI Dong-Qing,
来源:中国物理快报(英文版) 年份:2006
High-pressure behaviour of orthorhombic MgSiO3 perovskite crystal is simulated by using the density functional theory and plane-wave pseudopotentials approach u...
Chemical reaction initiation and metallization in shocked condensed-phase α-RDX crystals:first princ
[会议论文] 作者:Yuan Jiao-Nan,Wei Yong-Kai,Chen Xiang-Rong,Ji Guang-Fu,Wei Dong-Qing,
来源:第26届国际高压科学技术大会、第8届亚洲高压科技学术会议暨第19届中国高压科学技术会议(The 26th Interna 年份:2017
The initial decomposition and metallization of α-1,3,5-trinitroperhydro-1,3,5-triazine(RDX)under different shock wave velocities have been studied based on first principles molecular dynamics simulati...
Synthesis, Structure and DFT Calculations of a Novel Copper(Ⅱ) Complex Based on Tert-butyl 2-[N-(ter
[期刊论文] 作者:CHENG Ze-Ying,HU Hui-Ping,YANG Jin-Peng,QIU Xue-Jing,WANG Cai-Xia,JI Guang-Fu,
来源:黑龙江科技信息 年份:2017
本文通过对荣华二采区10...
[期刊论文] 作者:ZHANG Pin-Liang,GONG Zi-Zheng,JI Guang-Fu,WANG Qing-Song,SONG Zhen-Fei,CAO Yan,WANG Xiang,
来源:中国物理快报(英文版) 年份:2013
Shock compression experiments on a new kind of 47Zr45Ti5Al3V alloys at pressures between 28 and 200 GPa are performed using a two-stage light gas gun.The Hugoni...
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