Tuning the electronic properties of monolayer and bilayer transition metal dichalcogenide compounds under direct out-of-plane compression
- 26 April 2017
- journal article
- research article
- Published by Royal Society of Chemistry (RSC) in Physical Chemistry Chemical Physics
- Vol. 19 (20) , 13333-13340
Abstract
The band-gap modulation semiconducting MX 2 compounds (M = Mo or W, X = S or Se) under direct out-of-plane compression is systematically studied by means of the density functional theory formalism including spin–orbit coupling and dispersion correction.Keywords
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