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二维偶氮聚合物中的光致质量输运:极化效应的蒙特卡罗研究

Photoinduced Mass Transport in Azo-Polymers in 2D: Monte Carlo Study of Polarization Effects.

作者信息

Pawlik Grzegorz, Mitus Antoni C

机构信息

Department of Theoretical Physics, Wroclaw University of Science and Technology, 50-370 Wroclaw, Poland.

出版信息

Materials (Basel). 2020 Oct 22;13(21):4724. doi: 10.3390/ma13214724.

Abstract

We studied the impact of light polarization on photoinduced dynamics of model azo-polymer chains in two dimensions, using bond-fluctuation Monte Carlo simulations. For two limiting models-sensitive to and independent of light polarization-their dynamics driven by photoisomerization of azo-dyes as well as by thermal effects was studied, including characterization of mass transport and chain reorientations. The corresponding schemes of light-matter interaction promote qualitatively different dynamics of photoinduced motion of azo-polymer chains. In particular, they can inhibit or trigger off a directed mass transport along a gradient of light illumination. The generic dynamics of single chains is superdiffusive and is promoted by breaking a symmetry present in the polarization independent model.

摘要

我们使用键涨落蒙特卡罗模拟研究了光偏振对二维模型偶氮聚合物链光致动力学的影响。对于两个对光偏振敏感和不敏感的极限模型,研究了由偶氮染料的光异构化以及热效应驱动的动力学,包括质量输运和链重排的表征。相应的光-物质相互作用方案促进了偶氮聚合物链光致运动的定性不同的动力学。特别是,它们可以抑制或引发沿光照梯度的定向质量输运。单链的一般动力学是超扩散的,并且通过打破偏振无关模型中存在的对称性而得到促进。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/48db/7660191/3bf607e91d90/materials-13-04724-g001.jpg

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