exo- and endo-Complexes of Fe with Carbon Allotropic Modifications on the Example of Fullerene С.sub.60: a Density Function Theory Study

Structures of exo- and endo-complexes of fullerene C.sub.60 with zero-valent Fe.sup.0, in which the metal is localized inside and outside fullerene molecule, respectively, have been strictly revealed with the DFT method. The complexes structures ([eta].sup.6- and [eta].sup.2-, in which the iron atom...

Ausführliche Beschreibung

Bibliographische Detailangaben

Veröffentlicht in:	Russian journal of general chemistry 2021-05, Vol.91 (5), p.828
Hauptverfasser:	Zaitsev, K. V, Oprunenko, A. Yu, Gloriozov, I. P, Nechaev, M. S, Oprunenko, Yu. F, Kuznetsov, A. E
Format:	Artikel
Sprache:	eng
Schlagworte:	Analysis Chemical properties Thermodynamics Transition metal compounds
Online-Zugang:	Volltext
Tags:	Tag hinzufügen Keine Tags, Fügen Sie den ersten Tag hinzu!