- Conference date: 3–7 December 2012
- Location: Indian Institute of Technology, Bombay, Mumbai, India
In this paper we have developed an effective interaction potential model to study the high pressure phase transition of transition metal compounds TiX (X=N,O), having B1 structure at room temperature. We have theoretically investigated phase transition pressures and volume collapses including the temperature effect, and found results well suited with available experimental data. The elastic constants are also reported. The inclusion of temperature effect in TBIP makes the present model suitable for theoretical high-pressure studies.
- High pressure
- Elasticity theory
- Phase transitions
- Metal phase transitions
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