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Evaluating frontier orbital energy and HOMO/LUMO gap with descriptors from density functional reactivity theory

  • Ying Huang
  • , Chunying Rong
  • , Ruiqin Zhang*
  • , Shubin Liu*
  • *Corresponding author for this work

Research output: Journal Publications and ReviewsRGC 21 - Publication in refereed journalpeer-review

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