Rotational tunneling effects in 2H-NMR spectra of polycrystalline (ND4)2SnCl6
- 1 January 1988
- journal article
- conference paper
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 88 (1) , 58-67
- https://doi.org/10.1063/1.454486
Abstract
Rotational tunneling effects are analyzed in 2H‐NMR spectra of deuterated ammonium ions in powders. The spectra are generally composed of a strong central line from A symmetry species and weaker T sidebands. At a high magnetic field (∼6.5 T) the central line contains well‐resolved doublets. Their separations supply a direct measure of the rotational tunneling frequency νt in the range 0.1<νtt and the Larmor frequency ν0. Level crossing related effects may be detected in a ±0.75 or ±0.35 MHz range around that Larmor frequency which is equal to νt or 1/2 νt, respectively. Generally, only the fitting of the theoretical spectra to those measured at different ν0 allows an estimation of the tunneling frequency. The measurement of νt up to about 20 MHz becomes thus possible. The theoretical predictions are verified by results on a (ND4)2SnCl6 powder sample. High and low field spectra lead to slightly different values for the tunneling frequency at 4.2 K equal to 7.5 and 7.1 MHz, respectively. Tunneling to reorientation transition is followed through changes in the spectra and their second moments.Keywords
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