• 文献标题:   Experimental and theoretical investigation of relative optical band gaps in graphene generations
  • 文献类型:   Article
  • 作  者:   BHATNAGAR D, SINGH S, YADAV S, KUMAR A, KAUR I
  • 作者关键词:   graphene, graphene oxide, graphene quantum dot, optical band gap
  • 出版物名称:   MATERIALS RESEARCH EXPRESS
  • ISSN:   2053-1591
  • 通讯作者地址:   CSIR
  • 被引频次:   8
  • DOI:   10.1088/2053-1591/4/1/015101
  • 出版年:   2017

▎ 摘  要

Size and chemical functionalization dependant optical band gaps in graphene family nanomaterials were investigated by experimental and theoretical study using Tauc plot and density functional theory (DFT). We have synthesized graphene oxide through a modified Hummer's method using graphene nanoplatelets and sequentially graphene quantum dots through hydrothermal reduction. The experimental results indicate that the optical band gap in graphene generations was altered by reducing the size of graphene sheets and attachment of chemical functionalities like epoxy, hydroxyl and carboxyl groups plays a crucial role in varying optical band gaps. It is further confirmed by DFT calculations that the pi orbitals were more dominatingly participating in transitions shown by projected density of states and the molecular energy spectrum represented the effect of attached functional groups along with discreteness in energy levels. Theoretical results were found to be in good agreement with experimental results. All of the above different variants of graphene can be used in native or modified form for sensor design and optoelectronic applications.