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Immobilization of ultraviolet absorbers on graphene oxide nanosheets to be utilized as a multifunctional hybrid UV-blocker: A combined density functional theory and practical application

机译:紫外线吸收剂在氧化石墨烯纳米片上的固定化,以用作多功能混合型紫外线阻隔剂:结合密度泛函理论和实际应用

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摘要

This paper introduces a facile approach to synthesize a nano-structured light stabilizer composed of a typical ultra-violet absorber (UVA) and graphene oxide (GO) nano-sheets. Density functional theory (DFT) studies were performed to get a deeper insight into the UVA interactions with GO surface. It was observed that UVA bound to GO sheets via physisorption and chemisorption mechanisms. For practical purposes, the fabricated light stabilizer was incorporated to polyurethane (PU) coating. The weathering performance demonstrated that a considerable improvement (3 times in weathering stability compared to blank coating or PU coating loaded with GO and UVA separately) was achieved. (C) 2018 Elsevier B.V. All rights reserved.
机译:本文介绍了一种简便的方法来合成由典型的紫外线吸收剂(UVA)和氧化石墨烯(GO)纳米片组成的纳米结构光稳定剂。进行了密度泛函理论(DFT)研究,以更深入地了解UVA与GO表面的相互作用。观察到UVA通过物理吸附和化学吸附机制结合到GO片上。出于实际目的,将制造的光稳定剂掺入聚氨酯(PU)涂料中。耐候性能表明,可以实现相当大的改善(与分别装有GO和UVA的空白涂料或PU涂料相比,耐候稳定性提高了3倍)。 (C)2018 Elsevier B.V.保留所有权利。

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