The pressure–temperature phase diagram of pure Co based on first-principles calculations-Reference-Cited by-同舟云学术

The pressure–temperature phase diagram of pure Co based on first-principles calculations

Published:2017 Issue:33 Volume:19 Page:22061-22068
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Wang Cuiping¹²³⁴^ORCID,Li Cong¹²³⁴^ORCID,Han Jiajia¹²³⁴^ORCID,Yan Lihui¹²³⁴^ORCID,Deng Bin¹²³⁴^ORCID,Liu Xingjun¹²³⁴^ORCID

Affiliation:

1. College of Materials and Fujian Provincial Key Laboratory of Materials Genome

2. Xiamen University

3. Xiamen 361005

4. P. R. China

Abstract

We optimized the high pressure–temperature phase diagram of pure Co up to the liquidus temperature and 120 GPa, based on thermodynamic properties calculated using first-principles.

Funder

Natural Science Foundation of Fujian Province

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2017/CP/C7CP03775A

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