The electronic structure and magnetic moments of free Mn 2 + and Mn 3 + are characterized by 2p x-ray absorption and x-ray magnetic circular dichroism spectroscopy in a cryogenic ion trap that is coupled to a synchrotron radiation beamline. Our results directly show that localized magnetic moments of 5 μB are created by 3d5(6S) states at each ionic core, which are coupled ferromagnetically to form molecular high-spin states via indirect exchange that is mediated in both cases by a delocalized valence electron in a singly occupied 4s derived antibonding molecular orbital with an unpaired spin. This leads to total magnetic moments of 11 μB for Mn 2 + and 16 μB for Mn 3 +, with no contribution of orbital angular momentum.
|Journal||Journal of Chemical Physics|
|Publication status||Published - Jun 21 2015|
All Science Journal Classification (ASJC) codes
- Physics and Astronomy(all)
- Physical and Theoretical Chemistry