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Rotational motions of NH+4groups in NH4ZnF3studied by quasielastic neutron scattering

机译:Rotational motions of NH+4groups in NH4ZnF3studied by quasielastic neutron scattering

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The rotational behavior of the ammonium groups in the highhyphen;temperature cubic phase of the perovskite NH4ZnF3has been investigated, using incoherent quasielastic neutron scattering. The measurements were carried out for various wave vector transfers between 0.68 and 5.52 Aring;minus;1and for temperatures between the transition temperature of 115.1 and 300 K. The data are compared with some reorientational jump models. It is assumed that in the cubic phase the NH4group is a slightly distorted tetrahedron, apparently due to strong hydrogenndash;fluorine interactions. The degree of distortion could, however, not be determined. On the time scale of the experiment (quest;3ps) the reorientational behavior of the NH4group can be described by 90deg; jumps about its axis of smallest moment of inertia. Residence times between 0.4 and 7 ps were found. Their temperature dependence follows an Arrhenius behavior, yieldingEa/kB=580plusmn;15 K, which agrees with calculations for the quantum mechanical energy level scheme.

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