Dynamics in crystals of rigid organic molecules: contrasting the phonon frequencies calculated by molecular dynamics with harmonic lattice dynamics for imidazole and 5-azauracil

Author: Gray A. E.   Day G. M.   Leslie M.   Price S. L.  

Publisher: Taylor & Francis Ltd

ISSN: 1362-3028

Source: Molecular Physics, Vol.102, Iss.9-10, 2004-01, pp. : 1067-1083

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Abstract