Publication Date:
2017-04-20
Description:
Author(s): Mit H. Naik and Manish Jain We study the origin of layer dependence in band structures of two-dimensional (2D) materials. We find that the layer dependence, at the density functional theory (DFT) level, is a result of quantum confinement and the nonlinearity of the exchange-correlation functional. We use this to develop an eff… [Phys. Rev. B 95, 165125] Published Tue Apr 18, 2017
Keywords:
Electronic structure and strongly correlated systems
Print ISSN:
1098-0121
Electronic ISSN:
1095-3795
Topics:
Physics
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