Liquid-liquid transitions in low-Z materials: Parallel with high-pressure solid phase transitions

ORAL

Abstract

First-principles molecular dynamics simulations reported in [1] predict structural and electronic transitions in dense liquid sodium that are responsible for its exotic melting curve. In this talk, the possibility for observing similar behavior in other low-Z materials will be discussed. Results from ab initio calculations of several materials will be presented and compared with sodium. [1] Jean-Yves Raty, Eric Schwegler and Stanimir A. Bonev, submitted.

*Work supported by the NSERC of Canada.

Authors

  • Stanimir Bonev

    • Dalhousie University, Canada
    • Dalhousie University
  • Isaac Tamblyn

    • Dalhousie University, Canada
    • Dalhousie University
  • Adam Chaffey

    • Dalhousie University, Canada
  • Jean-Yves Raty

    • University of Li\`ege, Belgium
    • University of Liege, Belgium