Excited electron dynamics modeling of warm dense matter

  • Julius T. Su
  • , William A. Goddard

Research output: Contribution to journalArticlepeer-review

Abstract

We present a model (the electron force field, or eFF) based on a simplified solution to the time-dependent Schrödinger equation that with a single approximate potential between nuclei and electrons correctly describes many phases relevant for warm dense hydrogen. Over a temperature range of 0 to 100000 K and densities up to 1g/cm3, we find excellent agreement with experimental, path integral Monte Carlo, and linear mixing equations of state, as well as single-shock Hugoniot curves from shock compression experiments. In principle eFF should be applicable to other warm dense systems as well.

Original languageEnglish
Article number185003
JournalPhysical Review Letters
Volume99
Issue number18
DOIs
Publication statusPublished - 1 Nov 2007
Externally publishedYes

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