most citedA combined first-principles and thermodynamic approach to M-Nitronyl Nitroxide (M=Co, Mn) spin helices

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cond-mat.mtrl-sci2015★ 18 cited

A combined first-principles and thermodynamic approach to M-Nitronyl Nitroxide (M=Co, Mn) spin helices

Marco Scarrozza, Alessandro Vindigni, Paolo Barone +2

The properties of two molecular-based magnetic helices, composed of 3 metal Co and Mn ions bridged by Nitronyl Nitroxide radicals, are investigated by density functional calcula…