Spin‐inversion mechanisms in O2 binding to a model heme complex revisited by density function theory calculations

Saito, Kohei ; Watabe, Yuya ; Fujihara, Takashi ; Takayanagi, Toshiyuki ; Hasegawa, Jun‐ya

Journal of computational chemistry, 2020-04, Vol.41 (11), p.1130-1138 [Periódico revisado por pares]

Hoboken, USA: John Wiley & Sons, Inc

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