Ab-initio investigations on physisorption of alkaline earth metal atoms on monolayer hexagonal boron nitride (h-BN)
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DOI: 10.1016/j.jpcs.2018.03.007
Abstract: Abstract First-principles density functional theory (DFT) calculations are performed on the structural, electronic, magnetic and optical properties of alkaline earth metal (AEM) atoms-adsorbed hexagonal boron nitride (h-BN) structures. Different AEM atoms were adsorbed on the… read more here.
Keywords: adsorption; earth metal; aem atoms; hexagonal boron ... See more keywords