首页> 外文期刊>The Journal of Chemical Physics >Dynamic heterogeneity in the glass-like monoclinic phases of CBr _nCl _(4-n), n 0,1,2
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Dynamic heterogeneity in the glass-like monoclinic phases of CBr _nCl _(4-n), n 0,1,2

机译:CBr _nCl _(4-n),n 0,1,2的玻璃状单斜晶相中的动态异质性

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Glassy dynamics of rigid molecules is still a matter of controversy: the physics behind the relaxation process at time scales faster than that ruled by the viscosity, the so called Johari-Goldstein process, is not known. In this work we unravel the mechanism of such a process by using a simple molecular model in which the centers of mass of the molecules are forming an ordered lattice, and molecular reorientation is performed by jumps between equilibrium orientations. We have studied the dynamics of simple quasi-tetrahedral molecules CBr _nCl _(4-n), n 0, 1, 2, in their monoclinic phases by means of dielectric spectroscopy and nuclear quadrupole resonance: the first technique allows to measure in a broad time scale but it is insensitive to molecular particularities, while the second has a restricted time window but senses the movement of each chlorine atom separately. The dynamic picture emerging from these techniques is that the secondary relaxation process is related to the different molecular surroundings around each nonequivalent atom of the molecule. Dynamical heterogeneities thus seem to be the cause of the secondary relaxation in this simple model of glass.
机译:刚性分子的玻璃态动力学仍然是一个有争议的问题:松弛过程背后的物理学在时间尺度上比粘度所决定的速度更快,所谓的Johari-Goldstein过程尚不清楚。在这项工作中,我们通过使用一个简单的分子模型来阐明这种过程的机理,在该模型中,分子的质心形成有序的晶格,并且分子的重新取向是通过平衡取向之间的跳跃来进行的。我们已经通过介电谱和核四极共振研究了单准相中简单的准四面体分子CBr _nCl _(4-n),n 0,1,2,的动力学:第一种技术可以在很宽的范围内进行测量时标,但它对分子的特殊性不敏感,而第二种具有有限的时间窗口,但分别感知每个氯原子的运动。从这些技术中得出的动态图像是,二次弛豫过程与分子中每个非等价原子周围的不同分子周围环境有关。因此,动态异质性似乎是这种简单玻璃模型中二次松弛的原因。

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