Orientation of single crystals using linear approximations to NMR transits.

نویسندگان

  • Young-Sik Kye
  • Xingang Zhao
  • Gerard S Harbison
چکیده

We have derived analytical expressions for determining the orientation of high-symmetry single crystals from line-crossings in a single rotation plot. We demonstrate the utility of the method using the strontium-87 resonance in strontium nitrate. Employing our new method, which we call orientation of single crystals using linear approximations to NMR transits (OSCULANT), in combination with fourth-order perturbation theory, we obtain a highly accurate value for the quadrupole coupling constant, and an estimate for the chemical shielding anisotropy.

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عنوان ژورنال:
  • Journal of magnetic resonance

دوره 174 1  شماره 

صفحات  -

تاریخ انتشار 2005