Theoretical research on novel orthorhombic tungsten dinitride from first principles calculations

Author:

Li Qian12345ORCID,Wang Jianyun5674,Liu Hanyu891011

Affiliation:

1. College of Aeronautical Engineering

2. Binzhou University

3. Binzhou 256600

4. China

5. State Key Laboratory of Superhard Materials

6. Jilin University

7. Changchun 130012

8. Geophysical Laboratory

9. Carnegie Institution of Washington

10. Washington

11. USA

Abstract

We uncovered a novel WN2 structure (Cmc21, 46–113 GPa) which is dynamically stable and ultra-incompressible at atmospheric pressure.

Funder

National Natural Science Foundation of China

Natural Science Foundation of Shandong Province

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

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