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Fabio J F S Henrique1, Pierre M Esteves1

  • 1Instituto de Química, Universidade Federal do Rio de Janeiro, Av. Athos da, Silveira Ramos, 149, CT, A-622, Cid. Univ., Rio de Janeiro, 21941-909, RJ, Brazil.

ACS physical chemistry Au
|February 2, 2026
PubMed
概括

这项研究使用Born-Oppenheimer分子动力学 (BOMD) 来研究化. 单电子转移 (SET) 被证实是关键步骤,揭示了新的氧气转移途径,并挑战了芳香化学中的传统极性机制.

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