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Natkaniec, I.; Smirnov, L.S.; Shuvalov, L.A.
Frank Laboratory of Neutron Physics, Joint Institute for Nuclear Research, Dubna (Russian Federation)2002
Frank Laboratory of Neutron Physics, Joint Institute for Nuclear Research, Dubna (Russian Federation)2002
AbstractAbstract
[en] The effect of temperature and concentration on the lattice parameters and amplitude-weighted phonon density of states in mixed salts of ammonium-potassium halides is investigated by neutron powder diffraction and incoherent inelastic neutron scattering. In the disordered α-phase (NaCl type) ammonium ions exhibit a fast stochastic reorientation at phonon frequency rates down to ca. 80 K. At 10 K, the incoherent inelastic neutron scattering spectra display four distinct ammonium excitations: two (resonant) modes below and two (localized) above the Debye cut-off energy of potassium halides. High-frequency localized modes correspond to translational and librational vibrations of NH4 ions. These modes are typical for the ordered phases of ammonium halides. The effect of ammonium concentration on localized and resonant modes is studied for the K1-x(NH4)xI mixed salts. The harmonic excitations of ammonium in a hypothetical low-temperature α-phase of NH4I are approximated to ca. 30, 95, 155 and 250 cm-1. In a real low-temperature ordered γ-phase of NH4I, translational ammonium vibrations are observed at ca. 140-160 cm-1 and librational vibrations at ca.300 cm-1
Source
2002; 20 p; 20 refs., 8 figs. Presented at 7. French-Polish seminar 'Dynamics and Transformations of Molecular Materials', 14-18 Sep 1998, Stella Plage, France
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