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Hybrid functionals with fixed mixing parameter perform no better than PBE for fundamental band gaps of nanoscale materials

Hybrid functionals with fixed mixing parameter perform no better than PBE for fundamental band gaps of nanoscale materials

Wang, Xinquan; Dvorac, Marc; Wu, Zhigang
  • 期刊名称Physical Review B
  • 作者Wang, Xinquan; Dvorac, Marc; Wu, Zhigang
  • 卷第94卷
  • 期第19期
  • 印刷ISSN2469-9950
  • 电子ISSN2469-9969
  • 文件大小563.01KB
  • 发表时间2016-11-21
  • DOI10.1103/PhysRevB.94.195429
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