First-principles study of the alloying effects on the structural stability and mechanical properties of L12-Pt3Hf

Journal of Alloys and Compounds ◽

10.1016/j.jallcom.2021.161982 ◽

2021 ◽

pp. 161982

Author(s):

Xin Yao ◽

Yong Mao ◽

Ya-Fang Guo

Keyword(s):

Mechanical Properties ◽

Structural Stability ◽

First Principles ◽

First Principles Study ◽

Alloying Effects

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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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The Structural Stability and Mechanical Properties of $$\hbox {Cu}_{2}\hbox {MnAl}$$ Cu 2 MnAl and $$\hbox {Cu}_{2}\hbox {MnIn}$$ Cu 2 MnIn Under Pressure: First-Principles Study

Journal of Electronic Materials ◽

10.1007/s11664-018-6163-3 ◽

2018 ◽

Vol 47 (5) ◽

pp. 3005-3017 ◽

Author(s):

Lili Liu ◽

Xianshi Zeng ◽

Qingdong Gou ◽

Yuanxiu Ye ◽

Yufeng Wen ◽

...

Keyword(s):

Mechanical Properties ◽

Structural Stability ◽

First Principles ◽

First Principles Study

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Structural stability, electronic structures, mechanical properties and debye temperature of W-Re alloys: A first-principles study

Fusion Engineering and Design ◽

10.1016/j.fusengdes.2020.112081 ◽

2021 ◽

Vol 162 ◽

pp. 112081

Author(s):

Diyou Jiang ◽

Wenbo Xiao ◽

Desheng Liu ◽

Sanqiu Liu

Keyword(s):

Mechanical Properties ◽

Debye Temperature ◽

Structural Stability ◽

First Principles ◽

Electronic Structures ◽

First Principles Study

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A first principles study of structural stability, electronic structure and mechanical properties of ABeH3 (A = Li, Na)

10.1063/1.4917995 ◽

2015 ◽

Author(s):

M. Santhosh ◽

R. Rajeswarapalanichamy ◽

G. Sudha Priyanga ◽

S. Kanagaprabha ◽

A. Murugan ◽

...

Keyword(s):

Mechanical Properties ◽

Electronic Structure ◽

Structural Stability ◽

First Principles ◽

First Principles Study

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A first-principles study on structural stability and mechanical properties of polar intermetallic phases CaZn2and SrZn2

The Philosophical Magazine A Journal of Theoretical Experimental and Applied Physics ◽

10.1080/14786435.2014.971903 ◽

2014 ◽

Vol 94 (34) ◽

pp. 3945-3959 ◽

Author(s):

Wen-Cheng Hu ◽

Yong Liu ◽

De-Jiang Li ◽

Ke Li ◽

Hua-Lan Jin ◽

...

Keyword(s):

Mechanical Properties ◽

Structural Stability ◽

First Principles ◽

Intermetallic Phases ◽

First Principles Study

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Structural stability, mechanical properties and stacking fault energies of TiAl3 alloyed with Zn, Cu, Ag: First-principles study

Journal of Alloys and Compounds ◽

10.1016/j.jallcom.2016.01.106 ◽

2016 ◽

Vol 666 ◽

pp. 185-196 ◽

Author(s):

Hai Hu ◽

Xiaozhi Wu ◽

Rui Wang ◽

Zhihong Jia ◽

Weiguo Li ◽

...

Keyword(s):

Mechanical Properties ◽

Structural Stability ◽

First Principles ◽

Stacking Fault ◽

First Principles Study ◽

Stacking Fault Energies

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Structural stability, electronic structure and mechanical properties of ZnN and CdN: A first principles study

Computational Materials Science ◽

10.1016/j.commatsci.2014.12.012 ◽

2015 ◽

Vol 99 ◽

pp. 117-124 ◽

Author(s):

R. Rajeswarapalanichamy ◽

G. Sudha Priyanga ◽

A. Jemmy Cinthia ◽

K. Iyakutti

Keyword(s):

Mechanical Properties ◽

Electronic Structure ◽

Structural Stability ◽

First Principles ◽

First Principles Study

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The structural stability, lattice dynamics, electronic, thermophysical, and mechanical properties of the inverse perovskites A 3 OX: A comparative first‐principles study

International Journal of Energy Research ◽

10.1002/er.6098 ◽

2020 ◽

Author(s):

Muhammad A. Sattar ◽

Mehreen Javed ◽

Maamar Benkraouda ◽

Noureddine Amrane

Keyword(s):

Mechanical Properties ◽

Structural Stability ◽

First Principles ◽

Lattice Dynamics ◽

First Principles Study

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First principles study of structural stability, electronic structure and mechanical properties of ReN and TcN

Journal of Physics and Chemistry of Solids ◽

10.1016/j.jpcs.2014.11.013 ◽

2015 ◽

Vol 78 ◽

pp. 118-126 ◽

Author(s):

R. Rajeswarapalanichamy ◽

M. Kavitha ◽

G. Sudha Priyanga ◽

K. Iyakutti

Keyword(s):

Mechanical Properties ◽

Electronic Structure ◽

Structural Stability ◽

First Principles ◽

First Principles Study

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Alloying effects of Ta on the mechanical properties of γ’ Co3(Al, W): A first-principles study

Scripta Materialia ◽

10.1016/j.scriptamat.2014.11.029 ◽

2015 ◽

Vol 100 ◽

pp. 5-8 ◽

Author(s):

Weiwei Xu ◽

Yi Wang ◽

Cuiping Wang ◽

Xingjun Liu ◽

Zi-Kui Liu

Keyword(s):

Mechanical Properties ◽

First Principles ◽

First Principles Study ◽

Alloying Effects

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