DFT + U calculations for electronic, structural, and optical properties of ZnO wurtzite structure: A review

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DFT + U calculations for electronic, structural, and optical properties of ZnO wurtzite structure: A review

This review aims to briefly outline the Hubbard-U scheme and to investigate the effect of its inclusion in standard Density Functional Theory on electronic, structural, and optical properties of ZnO wurtzite structure. To remedy the miscalculation of optimized lattice parameters determined by Local...

وصف كامل

التفاصيل البيبلوغرافية
الحاوية / القاعدة:	Results in Physics
المؤلف الرئيسي:	2-s2.0-85075760738
التنسيق:	مقال
اللغة:	English
منشور في:	Elsevier B.V. 2020
الوصول للمادة أونلاين:	https://www.scopus.com/inward/record.uri?eid=2-s2.0-85075760738&doi=10.1016%2fj.rinp.2019.102829&partnerID=40&md5=59b1b23a5a05b184c5423074ef4442f0

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