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Phase stability, electronic structure and equation of state of cubic TcN from first-principles calculations
期刊论文
PHYSICS LETTERS A, 2016, 卷号: 380, 期号: 38, 页码: 3144-3148
作者:
Song, T.
;
Ma, Q.
;
Sun, X. W.
;
Liu, Z. J.
;
Fu, Z. J.
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  |  
浏览/下载:0/0
  |  
提交时间:2019/11/15
Phase stability
Electronic structure
Equation of state
TcN
High pressure
Structural transition behavior of ZnS nanotetrapods under high pressure
期刊论文
HIGH PRESSURE RESEARCH, 2015, 卷号: 35, 期号: 1, 页码: 9-15
作者:
Zhao, HF
;
Liu, W
;
Zhu, J
;
Shen, X
;
Xiong, L
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  |  
浏览/下载:24/0
  |  
提交时间:2016/04/18
ZnS nanotetrapods
phase-transition behavior
high pressure in situ ADXRD
Atomistic study of the pressure-induced phase-transition mechanism in GaAs by Mobius inversion potentials
期刊论文
2010, 2010
Cai, Jin
;
Nanxian, Chen
;
Wang, Huaiyu
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  |  
浏览/下载:2/0
Displacive phase transition, structural stability, and mechanical properties of the ultra-incompressible and hard MoN by first principles
期刊论文
physica status solidi b-basic solid state physics, 2010, 卷号: 247, 期号: 5, 页码: 1207-1213
Zhao EJ
;
Wang JP
;
Wu ZJ
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  |  
浏览/下载:14/0
  |  
提交时间:2012/06/06
MOLYBDENUM NITRIDES
HIGH-PRESSURE
DELTA-MON
ELECTRONIC-PROPERTIES
METAL NITRIDES
FILMS
SUPERCONDUCTIVITY
DIFFRACTION
Studies on thermodynamic properties of III-V compounds by first-principles response-function calculation
期刊论文
Physica Status Solidi B-Basic Solid State Physics, 2009, 卷号: 246, 期号: 7, 页码: 1618-1627
S. Q. Wang
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  |  
浏览/下载:13/0
  |  
提交时间:2012/04/13
ab-initio calculation
bond-charge model
space gaussian
pseudopotentials
temperature thermal-expansion
lattice-dynamical
properties
pressure dependences
gruneisen parameters
phonon
dispersions
elastic properties
electron-gas
Phase transition and elastic properties of BeO under pressure from first-principles calculations
期刊论文
Physica B-Condensed Matter, 2009, 卷号: 404, 期号: 14-15, 页码: 1940-1946
B. R. Yu
;
J. W. Yang
;
H. Z. Guo
;
G. F. Ji
;
X. R. Chen
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  |  
浏览/下载:12/0
  |  
提交时间:2012/04/13
First-principles calculations
Phase transitions
Elastic properties
BeO
beryllium-oxide
single-crystal
thermodynamic properties
electronic-properties
theoretical hardness
superhard materials
hexagonal beo
boron-nitride
ground-state
stability
Quaternary metallic ferrimagnets based on anti ferromagnetic semiconductor MnTe
期刊论文
PHYSICA B-CONDENSED MATTER, 2008, 卷号: 403, 期号: 18, 页码: 3239
Zhu, LF
;
Liu, BG
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浏览/下载:13/0
  |  
提交时间:2013/09/24
MAGNETIC SEMICONDUCTORS
ZINCBLENDE MNTE
CHALCOGENIDES
STABILITY
EPILAYERS
PHASE
Elastic and thermodynamic properties of c-BN from first-principles calculations
期刊论文
Chinese Physics, 2007, 卷号: 16, 期号: 1, 页码: 217-222
Y. J. Hao
;
Y. Cheng
;
Y. J. Wang
;
X. R. Chen
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  |  
浏览/下载:17/0
  |  
提交时间:2012/04/13
elastic constants
thermodynamic properties
local density
approximation
c-BN
cubic boron-nitride
superconducting mgb2
zincblende bn
constants
phase
aln
gan
transition
pressure
inn
First-principles calculations of elastic constants of c-BN
期刊论文
Physica B-Condensed Matter, 2006, 卷号: 382, 期号: 1-2, 页码: 118-122
Y. J. Hao
;
X. R. Chen
;
H. L. Cui
;
Y. L. Bai
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2012/04/13
elastic constants
local density approximation
Debye temperature
thermal expansion coefficients
c-BN
cubic boron-nitride
molecular-dynamics simulation
thermodynamic
properties
structural-properties
superconducting mgb2
thermal-expansion
zincblende bn
gan
aln
phase
Synthesis of zinc sulfide nanocrystals and fabrication of nanocrystal superlattice
期刊论文
2004
Kuzuya, T.
;
Tai, Y.
;
Yamamuro, S.
;
Hihara, T.
;
Peng, D. L.
;
Sumiyama, K.
;
彭栋梁
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  |  
浏览/下载:7/0
  |  
提交时间:2013/12/12
monodisperse nanocrystals
polymetallic thiolate cage
zinc sulfide
superlattice
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