Theoretical Study of the Super Exchange Mechanism and Magneto-Structural Relationships in the [Mn(III)2( μ-F)F4(Me3tacn)2](PF6) Coordination Compound

New J. Chem., 2018, Accepted Manuscript DOI: 10.1039/C8NJ02793E, PaperNicol ás Montenegro-Pohlhammer, Carmen J. Calzado, Dayán Páez-Hernández, Ramiro Arratia-Perez A detailed theoretical study of the electronic structure and magnetic properties of the dinuclear Mn(III) complex, [Mn(III)2( μ-F)F4(Me3tacn)2] (Complex 1), with a single fluoride bridge is reported. DFT and wave- function... The content of this RSS Feed (c) The Royal Society of Chemistry

Source: RSC - New J. Chem. latest articles - July 17, 2018 Category: Chemistry Authors: Nicol ás Montenegro-Pohlhammer Source Type: research