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  Application of computational chemistry in chemical reactivity: a review

  C. W. Chidiebere, C. E. Duru, JP. C. Mbagwu (Author)

  Molecular orbitals are vital to giving reasons several chemical reactions occur. Although, Fukui and coworkers were able to propose a postulate which shows that highest occupied molecular orbital (HOMO) …

  10.46481/jnsps.2021.347

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