Theory and simulation of vibrational effects on structural measurements by solid-state nuclear

Ishii, Yoshitaka; Terao, Takehiko; Hayashi, Soichi
August 1997
Journal of Chemical Physics;8/22/1997, Vol. 107 Issue 8, p2760
Academic Journal
Studies vibrational effects on structural parameters obtained by solid-state nuclear magnetic resonance (NMR). Theoretical calculations and molecular-dynamics simulations; Reduction of dipolar interactions by molecular vibration and intramolecular vibrations; Vibrational effects on bond and dihedral angles; Molecular dynamics simulations.


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