Yayınlanmış 1 Ocak 2015 | Sürüm v1
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Band gap characterization of ternary BB1-xNx (0 <= x <= 1) alloys using modified Becke-Johnson (mBJ) potential

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Açıklama

The semi-local Becke-Johnson (BJ) exchange-correlation potential and its modified form proposed by Tran and Blaha have attracted a lot of interest recently because of the surprisingly accurate band gaps they can deliver for many semiconductors and insulators (e.g., sp semiconductors, noble-gas solids, and transition-metal oxides). The structural and electronic properties of ternary alloys BB1 (-) N-x(x) (0

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bib-77562112-dbc7-45da-bea5-9f7c3510948b.txt

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md5:a345a767f7d33fcffd5338c15adbec7b
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