V. M. Mamaev, K. V. Ermakov, I. P. Gloriozov, M. N. Gradoboev, S. Ya. Ishchenko, D. A. Lemenovskii, “A theoretical study of the hydrogen molecule activation by the Ni2 cluster, nickel phthalocyanine and a complex formed by nickel phthalocyanine with the Ni2 cluster”, Mendeleev Commun., 11:5 (2001), 190

A theoretical study of the hydrogen molecule activation by the Ni₂ cluster, nickel phthalocyanine and a complex formed by nickel phthalocyanine with the Ni₂ cluster

V. M. Mamaev, K. V. Ermakov, I. P. Gloriozov, M. N. Gradoboev, S. Ya. Ishchenko, D. A. Lemenovskii

Department of Chemistry, M.V. Lomonosov Moscow State University, Moscow, Russian Federation

Аннотация: A new system based on the addition of the Ni₂ cluster to a mononuclear phthalocyanine complex with an energy stability of about 26 kcal mol^–1 was suggested for the barrierless activation of the H–H bond.

Язык публикации: английский

DOI: 10.1070/MC2001v011n05ABEH001473