Reconstructions of Ir (110) and (100): an ab initio study

Abstract

Prediction criteria for surface reconstructions are discussed, with reference to ab initio calculations of the (110)-$1\times 2$ missing-row and (100)-$5\times 1$ quasi-hexagonal reconstructions of Ir and Rh.

3 pages RevTeX two-column, to appear in Surface Science

References in corpus (2)

• Extracting convergent surface energies from slab calculations
• Reconstruction Mechanism of FCC Transition-Metal (001) Surfaces

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