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Novel superhard B–C–O phases predicted from first principles

  • Published:2016 Issue:3 Volume:18 Page:1859-1863
  • ISSN:1463-9076
  • Container-title:Physical Chemistry Chemical Physics
  • language:en
  • Short-container-title:Phys. Chem. Chem. Phys.

Author:

Wang Shengnan12345,Oganov Artem R.12345,Qian Guangrui12345,Zhu Qiang12345,Dong Huafeng12345,Dong Xiao678,Davari Esfahani M. Mahdi12345

Affiliation:

1. Department of Geosciences

2. Center for Materials by Design, and Institute for Advanced Computational Science

3. State University of New York

4. Stony Brook

5. USA

6. Center for High Pressure Science and Technology Advanced Research

7. Beijing 100193

8. China

Abstract

Structure of B4CO4. The purple, black and red balls are boron, carbon and oxygen atoms, respectively.

Funder

National Science Foundation

Defense Advanced Research Projects Agency

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference41 articles.

1. Architecture of multilayer nanocomposite coatings with super-hard diamond-like carbon layers for wear protection at high contact loads

2. V. Sarin , Comprehensive hard materials, Newnes, 2014, vol. 1

3. Hard and superhard nanocomposite coatings

4. R. F. Bunshah , et al., Handbook of hard coatings, Noyes Publications, New Jersey, 2001

5. On the hardness of a new boron phase, orthorhombic γ-B28

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