First principles studies of electronic and optical properties of helium adsorption on Sc-doped BN monolayer
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Title
First principles studies of electronic and optical properties of helium adsorption on Sc-doped BN monolayer
Authors
Keywords
Boron nitride (BN) monolayer, Helium adsorption, Sc-doped BN, NBO analysis, HSE06, GGA–PBE, DFT method, Molecular modeling
Journal
Journal of the Iranian Chemical Society
Volume 12, Issue 11, Pages 1983-1990
Publisher
Springer Nature
Online
2015-06-08
DOI
10.1007/s13738-015-0672-2
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