标题:Synthesis, characterisation and theoretical study by DFT calculations of the structural and electronic properties of the copolymer based on PVK and PEDOT
期刊名称:Journal of Materials and Environmental Science
印刷版ISSN:2028-2508
出版年度:2010
卷号:1
期号:S1
页码:337-342
出版社:University of Mohammed Premier Oujda
摘要:In this work, we present the study of the copolymer (PVK-PEDOT) which concerns the combination of the poly (N-vinylcarbazole) (PVK) properties and those of the poly (3,4-ethylenedioxythiophene) (PEDOT). We describe the protocol of the synthesis, the characterization and the electronic and vibrational properties of the resulting copolymer. In addition, we studied the structural and optoelectronic properties of the model oligomer (Cbz-Edot)3based on carbazole (Cbz) and ethylenedioxythiophene (Edot), using Density Functional Theory (DFT) with B3LYP/6-311G(d,p) calculations. The results obtained were compared with the experimental data