| Literature DB >> 24359111 |
Silvia Gómez-Coca1, Eduard Cremades, Núria Aliaga-Alcalde, Eliseo Ruiz.
Abstract
The work presented herein shows the experimental and theoretical studies of a mononuclear nickel(II) complex with the largest magnetic anisotropy ever reported. The zero-field-splitting D parameter, extracted from the fits of the magnetization and susceptibility measurements, shows a large value of -200 cm(-1), in agreement with the theoretical value of -244 cm(-1) obtained with the CASPT2-RASSI method.Entities:
Year: 2013 PMID: 24359111 DOI: 10.1021/ic402256v
Source DB: PubMed Journal: Inorg Chem ISSN: 0020-1669 Impact factor: 5.165