Solvation of ferrocene, cobaltocene, and their ions by the data of quantum-chemical calculations

Quantum-chemical calculations of solvation energy for ferrocene and cobaltocene molecules and their ionic forms in water, acetonitrile, methanol, acetone, and dimethylsulfoxide are performed in terms of the density functional method of the B3LYP type, taking into account the effect of solvent and us...

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Veröffentlicht in:	Russian journal of electrochemistry 2009, Vol.45 (1), p.87-92
Hauptverfasser:	Kuznetsov, An. M., Maslii, A. N., Krishtalik, L. I.
Format:	Artikel
Sprache:	eng
Schlagworte:	Chemistry Chemistry and Materials Science Electrochemistry Physical Chemistry
Online-Zugang:	Volltext
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