Exchange coupling in transition-metal complexes via density-functional theory: Comparison and reliability of different basis set approaches - Archive ouverte HAL Accéder directement au contenu
Article Dans Une Revue Journal of Chemical Physics Année : 2005
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hal-02644823 , version 1 (28-05-2020)

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Eliseo Ruiz, Antonio Rodríguez-Fortea, Javier Tercero, Thomas Cauchy, Carlo Massobrio. Exchange coupling in transition-metal complexes via density-functional theory: Comparison and reliability of different basis set approaches. Journal of Chemical Physics, 2005, 123 (7), pp.074102. ⟨10.1063/1.1999631⟩. ⟨hal-02644823⟩
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