Structure, stability, mechanical and electronic properties of Fe–P binary compounds by first-principles calculations-Reference-Cited by-同舟云学术

Structure, stability, mechanical and electronic properties of Fe–P binary compounds by first-principles calculations

Published:2015 Issue:100 Volume:5 Page:81943-81956
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Wu Jing¹²³⁴,Chong XiaoYu¹²³⁴,Zhou Rong¹²³⁴,Jiang YeHua¹²³⁴,Feng Jing¹²³⁴⁵

Affiliation:

1. Faculty of Material Science and Engineering

2. Kunming University of Science and Technology

3. Kunming 650093

4. People’s Republic of China

5. School of Engineering and Applied Sciences

Abstract

The equilibrium crystal structures, stability, elastic properties, hardness and electronic structures of all the Fe–P binary compounds are investigated systematically by first principles calculations.

Funder

National Natural Science Foundation of China

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2015/RA/C5RA09875K

Reference44 articles.

1. Thermodynamic analysis of the Fe–Ti–P ternary system by incorporating first-principles calculations into the CALPHAD approach

2. Structural, elastic and electronic properties of intermetallics in the Pt–Sn system: A density functional investigation

3. Inhomogeneous Electron Gas

4. Effect of pressure on the magnetization measurements of Fe2P

Cited by 26 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Study on interface characteristics of WC-Co doped Y rare earth element cemented carbide cutting tool and its influence on material properties;Materials Science and Technology;2024-08-11

2. New insight into the structural, elastic, dynamics and thermodynamic properties of Fe3P under high pressures;Vacuum;2024-03

3. A review of electrochemical glucose sensing based on transition metal phosphides;Journal of Applied Physics;2023-02-21

4. Unraveling the structure and composition sensitivity of transition metal phosphide toward catalytic performance of C2H2 semi-hydrogenation;Journal of Catalysis;2022-12

5. Theoretical prediction of the mechanical and thermodynamic characteristics of Fe2MnGa Heusler compounds with different crystal phases;Results in Physics;2022-07