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VBO for the interface. The dots and the cross denote the segregated In configurations and the CuPt-like configuration, respectively. The VBO ratio is shown in the inset.
Band offset for interfaces. The dots denote the cases where all indium is nearest neighbor to nitrogen, crosses where indium is randomly distributed and far away from nitrogen, and circles present the intermediate structures between these two extrema.
Longitudinal lattice constant (in Å), band gap, and shift in VBM from the bulk calculations, the shift in the electrostatic potential from the interface calculations , and finally the VBO . All energies are in the units of meV.
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