TiₓBy phases

The stability, elastic anisotropy and thermodynamic parameters of six TiₓBy phases are systematically calculated; TiB₂ with B/Ti ratio 2:1 exhibits the largest bulk modulus and Debye temperature.

Xiaoming, Wang · Ma, He · Zhang, Xudong · Chen, Lijia · Wu, Hao

Chemical Physics Letters 2023

Specifications

的体模量

{'zh': '255.0', 'en': ''} GPa

Advantages

Debye temperature of TiB₂: 1121 K

All six TiₓBy phases are structurally stable and metallic