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Quasielastic neutron scattering study of pyridinium cation reorientation in thiourea pyridinium nitrate inclusion compound

机译:硫脲硝酸吡啶鎓包合物中吡啶鎓阳离子重取向的准弹性中子散射研究

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摘要

The dynamics of the pyridinium cation in thiourea pyridinium nitrate inclusion compound has been studied using quasielastic neutron scattering in a wide temperature range (10-350 K), The elastic incoherent structure factor was determined from neutron backscattering and time-of-flight measurements and its analysis allows to describe in detail the geometry of the motions of the pyridinium cation. Our study reveals two types of motion having two different correlation times. The pyridinium cation reorients about the axis perpendicular to its molecular plane over inequivalent threefold potential energy barriers and also executes a faster out-of-plane motion about the axis passing through two opposite atoms of the ring. (c) 2008 American Institute of Physics.
机译:使用拟弹性中子散射在较宽的温度范围(10-350 K)中研究了硫脲硝酸吡啶鎓硝酸盐包合物中吡啶鎓阳离子的动力学,由中子反向散射和飞行时间测量及其弹性非相干结构因子来确定分析允许详细描述吡啶鎓阳离子运动的几何形状。我们的研究揭示了两种类型的运动,它们具有两个不同的相关时间。吡啶鎓阳离子围绕垂直于其分子平面的轴在不相等的三重势能垒上重新定向,并且还绕着穿过环的两个相对原子的轴执行更快的平面外运动。 (c)2008年美国物理研究所。

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