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First-principle study on the physical properties of ultra-incompressible ReB₂

Chunlei WANG , Qiuju SUN , Xuanyu SONG , Benhai YU

金属学报(英文版) doi:10.1016/S1006-7191(08)60100-3

The elastic and physical characteristics of ReB₂ crystal have been predicted through a method of density functional theory within the generalized gradient approximation (GGA). Five independent elastic constants are C₁₁=662 GPa, C₁₂=150 GPa, C

关键词: Rhenium diboride , null , null , null