剪切模量
材料科学
剪切(地质)
各向同性
各向异性
凝聚态物理
几何学
物理
数学
复合材料
光学
作者
David Roundy,C. R. Krenn,Marvin L. Cohen,J. W. Morris
标识
DOI:10.1080/01418610108216634
摘要
Abstract Using pseudopotential density functional theory within the local-density approximation, we calculate the ideal shear strengths of W for slip on {110}, {112} and {123} planes allowing for complete structural relaxation orthogonal to the applied shear. The strengths in the weak directions on all planes are found to be very nearly equal (about 18GPa, or 11% of the shear modulus G). Moreover, the shear instability occurs at approximately the same applied shear strain (17–18%). This unusual isotropy is explained in terms of the atomic configurations of high-energy saddle points reached during shear. Analysis of these saddle points may also offer a simple explanation for the prevalence of the pencil glide of dislocations on planes containing a (111) direction in bcc metals. Finally, we calculate the ideal cleavage strengths of W on {100} and compare our calculated ideal shear and cleavage strengths with experimental nanoindentation and whisker measurements. All these results can be rather simply understood using a Frenkel–Orowan crystallographic model.
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