English

Low compressible BP$_3$N$_6$

Materials Science 2019-12-19 v2

Abstract

Using first principles calculation, the structural and mechanical properties of BP3_3N6_6 which adopts an orthorhombic structure with space group Pna21_1 (no. 33), were determined at three different pressure values (0, 20 and 42.4~GPa). The nine independent elastic constants meet all necessary and sufficient conditions for mechanical stability criteria for an orthorhombic crystal. BP3_3N6_6 show strong resistance to volume change hence a potential low compressible material. The Vicker's hardness of BP3_3N6_6 was found to range between 49-51~GPa for different external pressures imposed on the crystal. These high values of Vicker's hardness implies that BP3_3N6_6 is a potential superhard material.

Keywords

Cite

@article{arxiv.1909.08879,
  title  = {Low compressible BP$_3$N$_6$},
  author = {George S. Manyali and James Sifuna},
  journal= {arXiv preprint arXiv:1909.08879},
  year   = {2019}
}

Comments

6 pages, 1 figure

R2 v1 2026-06-23T11:20:02.759Z