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个人信息Personal Information
教授
博士生导师
硕士生导师
主要任职:研究生院常务副院长
其他任职:辽宁省凝固控制与数字化制备技术重点实验室主任
性别:男
毕业院校:大连理工大学
学位:博士
所在单位:材料科学与工程学院
学科:材料加工工程
办公地点:研究生院;材料科学与工程学院
联系方式:tmwang@dlut.edu.cn
电子邮箱:tmwang@dlut.edu.cn
First-principles calculations of graphene-based polyaniline nano-hybrids for insight of electromagnetic properties and electronic structures
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论文类型:期刊论文
发表时间:2016-01-01
发表刊物:RSC ADVANCES
收录刊物:SCIE、EI
卷号:6
期号:77
页面范围:73915-73923
ISSN号:2046-2069
摘要:In situ polymerization between aniline and ammonium persulfate (APS) under acidic conditions is described for the preparation of graphene-based polyaniline hybrids with investigation of their electromagnetic properties. Samples were characterized by X-ray diffraction (XRD), Raman spectroscopy, Fourier transform infrared (FTIR), scanning electron microscopy (SEM), transition electron microscopy (TEM) and vector network analysis. The results revealed that the graphene-based PANI hybrids formed a uniform PANI particle coating on the graphene sheets. Such special structures lead to pi-pi interactions between graphene and PANI, and thus the electromagnetic absorption properties are significantly improved versus pure conducting polymers. The maximum reflection loss reaches -32.1 dB at 5.45 GHz with a thickness of 4 mm. The bandwidth (RL < -10 dB) reaches an amazing 5.62 GHz with a thickness of 2 mm. In particular, first-principles calculations based on density function theory (DFT) were carried out to uncover the relationship between dielectric properties and electronic structures.