Presentation Information
[G4-P102-25]Tailoring Thermodynamic Stability and Mechanical Properties of Tantalum Diboride as Sustainable and Hard-Coating Material: A Theoretical Design
*Annop Ektarawong1, Kunpot Mopoung1, Chayanon Atthapak1, Thiti Bovornratanaraks1, Björn Alling2 (1. Chulalongkorn Univ. (Thailand), 2. Linköping Univ. (Sweden))
Keywords:
Density functional theory calculations,Transition-metal diborides,Electronic band filling,Mechanical performance,Superhard materials