• 文献标题:   Upper and Lower Bounds on Infinite Summation of Pair Potential Energy between Atom and Single Graphene Sheet
  • 文献类型:   Article
  • 作  者:   INUI N
  • 作者关键词:  
  • 出版物名称:   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
  • ISSN:   0031-9015
  • 通讯作者地址:   Univ Hyogo
  • 被引频次:   0
  • DOI:   10.7566/JPSJ.87.104001
  • 出版年:   2018

▎ 摘  要

The infinite pairwise summation of the potential energy between an atom above a graphene sheet and carbon atoms arranged in a hexagonal lattice is considered. Its magnitude depends on the minimum distance between the atom and the graphene sheet, as well as the number of carbon atoms on concentric circles, whose center exists under the atom. Using an analytical expression for an upper bound on the number of carbon atoms on a circle, which is the number of solutions to a Diophantine equation, an upperbound on the magnitude of the interaction potential energy between a carbon atom and a graphene sheet is obtained. Upper and lower bounds on the van der Waals interaction potential are calculated as a specific example.