Theoretical prediction of structural stability, electronic and elastic properties of ZrSi2 under pressure-Reference-Cited by-同舟云学术

Theoretical prediction of structural stability, electronic and elastic properties of ZrSi2 under pressure

Published:2015 Issue:46 Volume:5 Page:36779-36786
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Hao Ruru¹²³⁴,Zhang Xinyu¹²³⁴,Qin Jiaqian⁵⁶⁷⁸^ORCID,Zhang Suhong¹²³⁴,Ning Jinliang¹²³⁴,Sun Na¹²³⁴,Ma Mingzhen¹²³⁴,Liu Riping¹²³⁴

Affiliation:

1. State Key Laboratory of Metastable Materials Science and Technology

2. Yanshan University

3. Qinhuangdao 066004

4. P. R. China

5. Metallurgy and Materials Science Research Institute

6. Chulalongkorn University

7. Bangkok 10330

8. Thailand

Abstract

The elastic constants, DOS, charge density distribution and the fundamental thermodynamic data such as the specific heat, thermal expansion coefficient and Debye temperature under different temperatures and pressures are theoretically determined.

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2015/RA/C5RA01964H

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4. Preparation and magnetic properties of single phase Ni2Si by reverse Rochow reaction

5. Refractory silicides for integrated circuits

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