most citedStructure-specific, mode-resolved phonon coherence and specularity at graphene grain boundaries

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cond-mat.mtrl-sci2016

Single-Layered Hittorf's Phosphorus: A Wide-Bandgap High Mobility 2D Material

Georg Schusteritsch, Martin Uhrin, Chris J. Pickard

We propose here a two-dimensional material based on a single layer of violet or Hittorf's phosphorus. Using first-principles density functional theory, we find it to be energetical…