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2017 | 132 | 4 | 1363-1370
Article title

Theoretical Calculations for Elastic and Thermodynamic Properties of NbN₂ under High Pressure

Content
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EN
Abstracts
EN
The structural and elastic properties of NbN₂ at high pressures were investigated through the first-principles calculation. Results indicate that NbN₂ is a potential hard material. NbN₂ meets mechanical stability criteria and possesses ductility within the pressure of 100 GPa. The elastic anisotropy under high pressure was achieved by the elastic anisotropy factors, which reduce with increasing pressure. Using the quasi-harmonic Debye model, we also investigated the thermodynamic properties of NbN₂.
Publisher

Year
Volume
132
Issue
4
Pages
1363-1370
Physical description
Dates
published
2017-10
received
2017-03-31
(unknown)
2017-07-29
Contributors
author
  • College of Physics and Electronic Engineering, Sichuan Normal University, Chengdu 610101, P.R. China
author
  • College of Physics and Electronic Engineering, Sichuan Normal University, Chengdu 610101, P.R. China
  • School of Micro-Electronics and Solid-State Electronics, University of Electronic Science and Technology, Chengdu 610054, P.R. China
author
  • College of Physics and Electronic Engineering, Sichuan Normal University, Chengdu 610101, P.R. China
author
  • College of Physics and Electronic Engineering, Sichuan Normal University, Chengdu 610101, P.R. China
author
  • College of Physics and Electronic Engineering, Sichuan Normal University, Chengdu 610101, P.R. China
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Document Type
Publication order reference
Identifiers
YADDA identifier
bwmeta1.element.bwnjournal-article-appv132n4p27kz
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