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A First-Principles Analysis of the Magnetism of Cu(II) Polynuclear Coordination Complexes: the Case of [Cu(4)(bpy)(4)(aspartate)(2)(H(2)O)(3)](ClO(4))(4)·2.5H(2)O

The magnetic structure of the [Cu(4)(bpy)(4)(aspartate)(2)(H(2)O)(3)](ClO(4))(4)·2.5 H(2)O crystal — using fractional coordinates determined at room-temperature — has been analysed in detail. This analysis has been carried out by extending our first principles bottom-up theoretical approach, which w...

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Bibliografiske detaljer
Udgivet i:Molecules
Main Authors: Deumal, Mercè, Ribas-Ariño, Jordi, Robb, Michael A., Ribas, Joan, Novoa, Juan J.
Format: Artigo
Sprog:Inglês
Udgivet: MDPI 2004
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC6147295/
https://ncbi.nlm.nih.gov/pubmed/18007475
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/90900757
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