A First-Principles Analysis of the Magnetism of CuII Polynuclear Coordination Complexes: the Case of [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4•2.5H2O

A First-Principles Analysis of the Magnetism of CuII Polynuclear Coordination Complexes: the Case of [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4•2.5H2O

The magnetic structure of the [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4·2.5 H2Ocrystal — using fractional coordinates determined at room-temperature — has beenanalysed in detail. This analysis has been carried out by extending our first principlesbottom-up theoretical approach, which was ini...

Full description

Bibliographic Details
Main Authors: Juan J. Novoa, Joan Ribas, Michael A. Robb, Jordi Ribas-Ariño, Mercè Deumal
Format: Article
Language:English
Published: MDPI AG 2004-08-01
Series:Molecules
Subjects:
Molecular magnetism
through-bond interactions
CuII clusters
magnetic susceptibility curves
theoretical studies.
Online Access:http://www.mdpi.com/1420-3049/9/9/757/

Internet

http://www.mdpi.com/1420-3049/9/9/757/

Similar Items