• 文献标题:   An experimental and steered molecular dynamics simulation approach to histidine assisted liquid-phase exfoliation of graphite into few-layer graphene
  • 文献类型:   Article
  • 作  者:   ELUMALAI S, JABER SB, CHANDRASEKARAN S, OGAWA M
  • 作者关键词:  
  • 出版物名称:   PHYSICAL CHEMISTRY CHEMICAL PHYSICS
  • ISSN:   1463-9076 EI 1463-9084
  • 通讯作者地址:   Vidyasirimedhi Inst Sci Technol VISTEC
  • 被引频次:   1
  • DOI:   10.1039/d0cp01033b
  • 出版年:   2020

▎ 摘  要

A simple and green approach to exfoliate graphite in water was developed by its reaction with an amino acid, histidine (His), resulting in the spatial expansion of the interlayer space. Subsequent sonication led to few-layered nanosheets of graphene in water. Steered molecular dynamics (MD) simulations revealed that the exfoliating graphene sheet underwent sheered motion before completely scaling off from the other layer.