• 文献标题:   Optical Properties and Charge-Transfer Excitations in Edge-Functionalized All-Graphene Nanojunctions
  • 文献类型:   Article
  • 作  者:   COCCHI C, PREZZI D, RUINI A, CALDAS MJ, MOLINARI E
  • 作者关键词:  
  • 出版物名称:   JOURNAL OF PHYSICAL CHEMISTRY LETTERS
  • ISSN:   1948-7185
  • 通讯作者地址:   CNR
  • 被引频次:   33
  • DOI:   10.1021/jz200472a
  • 出版年:   2011

▎ 摘  要

We investigate the optical properties of edge-fiinctionalized graphene nanosystems, focusing on the formation of junctions and charge-transfer excitons. We consider a class of graphene structures that combine the main electronic features of graphene with the wide tunability of large polycyclic aromatic hydrocarbons. By investigating prototypical ribbon-like systems, we show that, upon convenient choice of functional groups, low-energy excitations with remarkable charge-transfer character and large oscillator strength are obtained. These properties can be further modulated through an appropriate width variation, thus spanning a wide range in the low-energy region of the UV-vis spectra. Our results are relevant in view of designing all-graphene optoelectronic nanodevices, which take advantage of the versatility of molecular functionalization, together with the stability and the electronic properties of graphene nanostructures.