First-principles study of structural stability and elastic properties of the ordered Si0.5Ge0.5 alloy under high pressure

Aimin Hao; Lixin Zhang; Zhongming Gao; Yan Zhu; Liu Riping

doi:10.1002/pssb.201000745

First-principles study of structural stability and elastic properties of the ordered Si0.5Ge0.5 alloy under high pressure

physica status solidi (b) ◽

10.1002/pssb.201000745 ◽

2011 ◽

Vol 248 (5) ◽

pp. 1135-1138 ◽

Cited By ~ 9

Author(s):

Aimin Hao ◽

Lixin Zhang ◽

Zhongming Gao ◽

Yan Zhu ◽

Liu Riping

Keyword(s):

High Pressure ◽

Elastic Properties ◽

Structural Stability ◽

First Principles ◽

First Principles Study

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First-principles study of high-pressure structural stability and mechanical properties of Ni2B

Computational Materials Science ◽

10.1016/j.commatsci.2021.110465 ◽

2021 ◽

Vol 194 ◽

pp. 110465

Author(s):

Menglong Wang ◽

Jialing Xie ◽

Keying Xue ◽

Lingxia Li

Keyword(s):

Mechanical Properties ◽

High Pressure ◽

Structural Stability ◽

First Principles ◽

First Principles Study

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A first-principles study on lattice dynamics, thermodynamics and elastic properties of lithium selenide under high pressure

Computational Materials Science ◽

10.1016/j.commatsci.2013.07.023 ◽

2013 ◽

Vol 79 ◽

pp. 903-907 ◽

Cited By ~ 3

Author(s):

Xudong Zhang ◽

Caihong Ying ◽

Guimei Shi ◽

Zhijie Li ◽

Haifeng Shi

Keyword(s):

High Pressure ◽

Elastic Properties ◽

First Principles ◽

Lattice Dynamics ◽

First Principles Study

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First-principles study of structural stability, electronic, optical and elastic properties of binary intermetallic: PtZr

10.1063/1.4946063 ◽

2016 ◽

Author(s):

Gitanjali Pagare ◽

Ekta Jain ◽

S. P. Sanyal

Keyword(s):

Elastic Properties ◽

Structural Stability ◽

First Principles ◽

First Principles Study

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Lattice dynamics, thermodynamics and elastic properties of Li2Te under high pressure: first principles study

Materials Science and Technology ◽

10.1179/1743284713y.0000000423 ◽

2013 ◽

Vol 30 (6) ◽

pp. 732-738 ◽

Cited By ~ 12

Author(s):

X. D. Zhang ◽

H. F. Shi

Keyword(s):

High Pressure ◽

Elastic Properties ◽

First Principles ◽

Lattice Dynamics ◽

First Principles Study

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First-principles study on the phase transition, elastic properties and electronic structure of Pt3Al alloys under high pressure

Journal of Alloys and Compounds ◽

10.1016/j.jallcom.2014.02.001 ◽

2014 ◽

Vol 597 ◽

pp. 200-204 ◽

Cited By ~ 13

Author(s):

Yanjun Liu ◽

Huawei Huang ◽

Yong Pan ◽

Guanghui Zhao ◽

Zheng Liang

Keyword(s):

Phase Transition ◽

High Pressure ◽

Electronic Structure ◽

Elastic Properties ◽

First Principles ◽

First Principles Study

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First principles study on interstitial C and substitutional Mn in bcc iron: structural stability and elastic properties

Materials Research Innovations ◽

10.1179/1432891714z.000000000548 ◽

2014 ◽

Vol 18 (sup2) ◽

pp. S2-775-S2-779 ◽

Cited By ~ 1

Author(s):

B. Kou ◽

Z. Kou ◽

Y. Liu ◽

P. Han

Keyword(s):

Elastic Properties ◽

Structural Stability ◽

First Principles ◽

First Principles Study ◽

Bcc Iron

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First principles study of the elastic properties of Li2MnSiO4−ySy

Journal of Materials Chemistry A ◽

10.1039/c5ta00230c ◽

2015 ◽

Vol 3 (10) ◽

pp. 5449-5456 ◽

Cited By ~ 16

Author(s):

Lin Zhu ◽

Lin Li ◽

Taimin Cheng ◽

Dongsheng Xu

Keyword(s):

Elastic Properties ◽

Structural Stability ◽

First Principles ◽

First Principles Calculations ◽

First Principles Study ◽

Silicate Materials ◽

Charge Discharge

First principles calculations were performed to investigate the elastic properties of Li2MnSiO4−ySy (y = 0, 0.5, 1, 2, 4) with the aim of improving the structural stability of silicate materials during charge/discharge cycles.

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First principles study on lattice dynamics, thermodynamics and elastic properties of Na2Te under high pressure

Physica Scripta ◽

10.1088/0031-8949/88/03/035602 ◽

2013 ◽

Vol 88 (3) ◽

pp. 035602 ◽

Cited By ~ 6

Author(s):

Xudong Zhang ◽

Caihong Ying ◽

He Ma ◽

Guimei Shi ◽

Zhijie Li

Keyword(s):

High Pressure ◽

Elastic Properties ◽

First Principles ◽

Lattice Dynamics ◽

First Principles Study

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First-principles study of structural stabilities, electronic and elastic properties of BaF2 under high pressure

Computational Materials Science ◽

10.1016/j.commatsci.2010.05.045 ◽

2010 ◽

Vol 49 (3) ◽

pp. 530-534 ◽

Cited By ~ 9

Author(s):

Xiaocui Yang ◽

Aimin Hao ◽

Xiaoming Wang ◽

Xin Liu ◽

Yan Zhu

Keyword(s):

High Pressure ◽

Elastic Properties ◽

First Principles ◽

First Principles Study

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First-principles study of high pressure structure phase transition and elastic properties of titanium

Solid State Sciences ◽

10.1016/j.solidstatesciences.2010.06.010 ◽

2010 ◽

Vol 12 (8) ◽

pp. 1473-1479 ◽

Cited By ~ 29

Author(s):

YanJun Hao ◽

Jun Zhu ◽

Lin Zhang ◽

JianYing Qu ◽

HaiSheng Ren

Keyword(s):

Phase Transition ◽

High Pressure ◽

Elastic Properties ◽

First Principles ◽

First Principles Study ◽

Structure Phase ◽

Structure Phase Transition

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