Publication
The magnetic shielding tensors of protons of water in barium chlorate monohydrate are investigated at room temperature by means of solid-state NMR spectroscopy, both for static powders and under magic-angle spinning conditions, using one- and two-dimensional techniques. First-principles DFT calculations based on a periodic planewave pseudopotential formalism for a static periodic system provide support for our spectral interpretation and corroborate the experimental findings in the fast motion regime.
David Lyndon Emsley, Marinella Mazzanti, Anne-Sophie Chauvin, Dominik Józef Kubicki, Gabriele Stevanato, Georges Guévork Jean-Jacques Menzildjian