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"Energetics of [Fe(NCH)6]2+ via CASPT2 calculations: ..."

Mikaël Kepenekian et al. (2009)

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DOI: 10.1002/JCC.21236

access: closed

type: Journal Article

metadata version: 2020-04-01

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Mikaël Kepenekian, Vincent Robert, Boris Le Guennic, Coen de Graaf:
Energetics of [Fe(NCH)₆]²⁺ via CASPT2 calculations: A spin-crossover perspective. J. Comput. Chem. 30(14): 2327-2333 (2009)

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