Characterization of Zn q+ –imidazole (q = 0, 1, 2) organometallic complexes: DFT methods vs. standard and explicitly correlated post-Hartree–Fock methods - Archive ouverte HAL Accéder directement au contenu
Article Dans Une Revue Physical Chemistry Chemical Physics Année : 2015

Characterization of Zn q+ –imidazole (q = 0, 1, 2) organometallic complexes: DFT methods vs. standard and explicitly correlated post-Hartree–Fock methods

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hal-01673171 , version 1 (28-12-2017)

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K. Boussouf, R. Boulmene, M. Prakash, N. Komiha, M. Taleb, et al.. Characterization of Zn q+ –imidazole (q = 0, 1, 2) organometallic complexes: DFT methods vs. standard and explicitly correlated post-Hartree–Fock methods. Physical Chemistry Chemical Physics, 2015, 17 (22), pp.14417 - 14426. ⟨10.1039/c4cp06108j⟩. ⟨hal-01673171⟩
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