Order in dense hydrogen at low temperatures

Proc Natl Acad Sci U S A. 2004 Mar 23;101(12):4013-8. doi: 10.1073/pnas.0307331101. Epub 2004 Mar 17.

Abstract

By increase in density, impelled by pressure, the electronic energy bands in dense hydrogen attain significant widths. Nevertheless, arguments can be advanced suggesting that a physically consistent description of the general consequences of this electronic structure can still be constructed from interacting but state-dependent multipoles. These reflect, in fact self-consistently, a disorder-induced localization of electron states partially manifesting the effects of proton dynamics; they retain very considerable spatial inhomogeneity (as they certainly do in the molecular limit). This description, which is valid provided that an overall energy gap has not closed, leads at a mean-field level to the expected quadrupolar coupling, but also for certain structures to the eventual emergence of dipolar terms and their coupling when a state of broken charge symmetry is developed. A simple Hamiltonian incorporating these basic features then leads to a high-density, low-temperature phase diagram that appears to be in substantial agreement with experiment. In particular, it accounts for the fact that whereas the phase I-II phase boundary has a significant isotope dependence, the phase II-III boundary has very little.

Publication types

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

MeSH terms

  • Cold Temperature*
  • Deuterium / chemistry
  • Hydrogen / chemistry*
  • Kinetics
  • Pressure
  • Thermodynamics

Substances

  • Hydrogen
  • Deuterium