First-principles study of interface relaxation effect on interface and electronic structures of InAs/GaSb superlattices with different interface types

2011 ◽  
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pp. 81-90 ◽  
Author(s):  
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Mei-Cheng Li ◽  
Lian-Cheng Zhao
Keyword(s):  
First Principles ◽  
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First Principles Study

scholarly journals Novel structural phases and the properties of LaX (X = P, As) under high pressure: first-principles study

RSC Advances ◽  
2021 ◽  
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Yu Zhou ◽  
Lan-Ting Shi ◽  
A-Kun Liang ◽  
Zhao-Yi Zeng ◽  
Xiang-Rong Chen ◽  
...  
Keyword(s):  
Phase Transition ◽  
High Pressure ◽  
Thermodynamic Properties ◽  
First Principles ◽  
Electronic Structures ◽  
Pressure Range ◽  
Mechanical Stability ◽  
First Principles Study

The structures, phase transition, mechanical stability, electronic structures, and thermodynamic properties of lanthanide phosphates (LaP and LaAs) are studied in the pressure range of 0 to 100 GPa by first principles.

scholarly journals First-principles study on the electronic structures of spin-Peierls compound GeCuO3

2008 ◽  
Vol 57 (4) ◽  
pp. 2368
Author(s):  
Ming Xing ◽  
Fan Hou-Gang ◽  
Hu Fang ◽  
Wang Chun-Zhong ◽  
Meng Xing ◽  
...  
Keyword(s):  
First Principles ◽  
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First Principles Study

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2016 ◽  
Vol 120 (8) ◽  
pp. 4638-4646 ◽  
Author(s):  
Jin Xiao ◽  
Mengqiu Long ◽  
Chao-Sheng Deng ◽  
Jun He ◽  
Li-Ling Cui ◽  
...  
Keyword(s):  
First Principles ◽  
Electronic Structures ◽  
First Principles Study
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