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Lithium halide monolayer sheets: First-principles many-body calculations

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0 Published in 2018 at "Computational Materials Science"

DOI: 10.1016/j.commatsci.2017.11.003

Abstract: Abstract The geometric, electronic and optical properties of two-dimensional lithium halide (LiF, LiCl, LiBr) monolayers are systematically explored by using ab initio density functional theory, the HSE06 functional, the GWA method and Bethe–Salpeter equation calculations.… read more here.

Keywords: many body; lithium halide; optical properties; monolayer sheets ... See more keywords