[P] P214~P221

4:00 PM - 5:30 PM JST(7:00 AM - 8:30 AM UTC)

[P221] Reconsideration on Lattice Parameters of Mo-based Binary Alloys in King’s Table using the First-principle Calculations

*Mohan LIU¹, Kyosuke Yoshimi² (1. Tohoku Univ. (Graduate student)、2. Tohoku Univ.)

Keywords:

First-principle Calculations,King's Table,Mo-based Binary Alloys,Lattice Parameters

The lattice parameters and volume size factors of Mo-based binary solid solutions are simulated by the first principles calculations at 0 K and different temperatures to reconsider the King Table.