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Hybrid density functional of HSE06 has been adopted to investigate the geometry and electronic properties of SrTiO3/NaTaO3 heterostructures in contrast with the cubic SrTiO3 and cubic NaTaO3. The SrTiO3/NaTaO3 heterostructures with varied monolayers of SrTiO3 and NaTaO3 units are constructed, and all the heterojunction systems have the smaller bandgaps as compared with those of pure SrTiO3 and NaTaO...
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