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Strain effects on effective masses for MoS2 monolayers

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Published under licence by IOP Publishing Ltd
, , Citation E R Ortiz et al 2015 J. Phys.: Conf. Ser. 609 012008 DOI 10.1088/1742-6596/609/1/012008

1742-6596/609/1/012008

Abstract

We have studied the effects of both intrinsic and external factors, such as strain, substrate and electric field, over a MoS2 monolayer, via DFT simulations. From these simulations we computed the system's bandstructure and evaluate the bandgap values, extracting the effective masses as well. Our calculations show a transition between direct and indirect gaps when strain is applied, and also that the bandstructure is barely affected by the presence of a substrate or an external electric field with values up to 1 V/Å.

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10.1088/1742-6596/609/1/012008