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- W2019756870 abstract "We carried a theoretical investigation on the structural and electronic properties of mercuric iodide in the red tetragonal crystalline phase, and its respective intrinsic defects. The calculations were performed using the total energy spin-polarized augmented plane wave method and the generalized gradient approximation, considering full atomic relaxation. The results were compared to available experimental data." @default.
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- W2019756870 date "2003-12-01" @default.
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- W2019756870 title "Defects in mercuric iodide: an APW investigation" @default.
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- W2019756870 doi "https://doi.org/10.1016/j.physb.2003.09.236" @default.
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