paper

Silicane and germanane: tight-binding and first-principles studies

arXiv:1401.2365 · doi:10.1088/2053-1583/1/1/011005

Abstract

We present a first-principles and tight-binding model study of silicane and germanane, the hydrogenated derivatives of two-dimensional silicene and germanene. We find that the materials are stable in freestanding form, analyse the orbital composition, and derive a tight-binding model using first-principles calculations to fit the parameters.

Published in "2D Materials"

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