• 文献标题:   First-principles studies on infrared properties of semiconducting graphene monoxide
  • 文献类型:   Article
  • 作  者:   PU HH, MATTSON EC, RHIM SH, GAJDARDZIKSAJOSIFOVSKA M, HIRSCHMUGL CJ, WEINERT M, CHEN JH
  • 作者关键词:  
  • 出版物名称:   JOURNAL OF APPLIED PHYSICS
  • ISSN:   0021-8979 EI 1089-7550
  • 通讯作者地址:   Univ Wisconsin
  • 被引频次:   2
  • DOI:   10.1063/1.4826910
  • 出版年:   2013

▎ 摘  要

Graphene monoxide (GMO), a recently proposed 2D crystalline material in the graphene family, is attractive for next-generation nanoelectronics because of its predicted tunable band gap. As a guide to GMO experimental characterization, we calculate the vibrational properties and obtain three infrared active vibration modes (B-1u, B-2u, and B-3u) and six Raman active modes (B-1g, B-2g, 2B(3g), and 2A(g)) for intrinsic GMO. The frequencies of the infrared active modes depend on both local structural deformations and interactions between adjacent GMO layers. These results are consistent with experimental observations and provide a means of estimating the number of layers in intrinsic GMO. (C) 2013 AIP Publishing LLC.