[ASAP] Computation of NMR Shifts for Paramagnetic Solids Including Zero-Field-Splitting and Beyond-DFT Approaches. Application to LiMPO4 (M = Mn, Fe, Co, Ni) and MPO4 (M = Fe, Co)

The Journal of Physical Chemistry C

DOI: 10.1021/acs.jpcc.8b09645

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