Journal
APPLIED PHYSICS LETTERS
Volume 89, Issue 2, Pages -Publisher
AMER INST PHYSICS
DOI: 10.1063/1.2220549
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The elastic stiffness and shear deformation mode of Al3BC3, a metal borocarbide containing linear C-B-C units, are studied based on the first-principles total energy calculations. The predominant effect of C-B-C units on mechanical properties is reported by leading to low shear modulus. The low shear-strain resistance originates from the deformation mode as follows: the rigid linear C-B-C units tilt with respect to the c direction easily, and the corner-sharing Al5C bipyramid slabs simultaneously slide along the basal plane with low resistance. The proposed deformation mode may be universal for the ternary metal borocarbides family containing short linear C-B-C units. (c) 2006 American Institute of Physics.
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