An electron counting formula to explain and to predict hydrogenated and metallated borophenes.
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DOI: 10.1039/d2cc03218j
Abstract: A generalized electron counting rule for borophene with varying hole density explains the preference for hydrogenation in β12 borophene of hole density ⅙. Interplay between bridging and terminal BH bonds controls the strength of interaction… read more here.
Keywords: electron counting; predict hydrogenated; hydrogenated metallated; explain predict ... See more keywords