Journal
PHYSICAL REVIEW B
Volume 72, Issue 12, Pages -Publisher
AMER PHYSICAL SOC
DOI: 10.1103/PhysRevB.72.125326
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The equilibrium crystal shapes of the group-IV materials diamond, Si, and Ge are constructed based on surface energies obtained by means of ab initio calculations. The same method is applied to constrained crystallites with a pyramidal shape and a fixed orientation of the basal plane. Trends of shape are discussed versus the constraints and the orientation of facets using only energetical arguments.
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