Predicting experimentally stable allotropes: Instability of penta-graphene

Proc Natl Acad Sci U S A. 2015 Dec 22;112(51):15609-12. doi: 10.1073/pnas.1520402112. Epub 2015 Dec 7.

Abstract

In recent years, a plethora of theoretical carbon allotropes have been proposed, none of which has been experimentally isolated. We discuss here criteria that should be met for a new phase to be potentially experimentally viable. We take as examples Haeckelites, 2D networks of sp(2)-carbon-containing pentagons and heptagons, and "penta-graphene," consisting of a layer of pentagons constructed from a mixture of sp(2)- and sp(3)-coordinated carbon atoms. In 2D projection appearing as the "Cairo pattern," penta-graphene is elegant and aesthetically pleasing. However, we dispute the author's claims of its potential stability and experimental relevance.

Keywords: Haeckelite; allotropes; modeling; nanocarbon; penta-graphene.

Publication types

  • Research Support, Non-U.S. Gov't
  • Research Support, U.S. Gov't, Non-P.H.S.