Literature DB >> 12626753

Liquid-liquid phase transition in compressed hydrogen from first-principles simulations.

Sandro Scandolo1.   

Abstract

The properties of compressed liquid hydrogen, the most abundant fluid in the universe, have been investigated by means of first-principles molecular dynamics at pressures between 75 and 175 GPa and temperatures closer to the freezing line than so far reported in shock-wave experiments. Evidence for a liquid-liquid transition between a molecular and a dissociated phase is provided. The transition is accompanied by a 6% increase in density and by metallization. This finding has important implications for our understanding of the interiors of giant planets and supports predictions of a quantum fluid state at low temperatures.

Entities:  

Year:  2003        PMID: 12626753      PMCID: PMC152244          DOI: 10.1073/pnas.0038012100

Source DB:  PubMed          Journal:  Proc Natl Acad Sci U S A        ISSN: 0027-8424            Impact factor:   11.205


  13 in total

1.  Metallization of fluid molecular hydrogen at 140 GPa (1.4 Mbar).

Authors: 
Journal:  Phys Rev Lett       Date:  1996-03-11       Impact factor: 9.161

2.  Spectroscopic studies of the vibrational and electronic properties of solid hydrogen to 285 GPa.

Authors:  A F Goncharov; E Gregoryanz; R J Hemley; H Mao
Journal:  Proc Natl Acad Sci U S A       Date:  2001-11-20       Impact factor: 11.205

3.  Molecular dynamics in dense hydrogen.

Authors: 
Journal:  Phys Rev Lett       Date:  1993-07-26       Impact factor: 9.161

4.  Unified approach for molecular dynamics and density-functional theory.

Authors: 
Journal:  Phys Rev Lett       Date:  1985-11-25       Impact factor: 9.161

5.  Sound velocities in dense hydrogen and the interior of jupiter.

Authors:  T S Duffy; W L Vos; C S Zha; R J Hemley; H K Mao
Journal:  Science       Date:  1994-03-18       Impact factor: 47.728

6.  Measurements of the equation of state of deuterium at the fluid insulator-metal transition

Authors: 
Journal:  Science       Date:  1998-08-21       Impact factor: 47.728

7.  Insulator-metal transition in solid hydrogen: Implication of electronic-structure calculations for recent experiments.

Authors: 
Journal:  Phys Rev B Condens Matter       Date:  1995-09-15

8.  Fluid hydrogen at high density: Pressure ionization.

Authors: 
Journal:  Phys Rev A       Date:  1992-08-15       Impact factor: 3.140

9.  Ab initio calculation of the sound velocity of dense hydrogen: implications for models of Jupiter.

Authors:  A Alavi; M Parrinello; D Frenkel
Journal:  Science       Date:  1995-09-01       Impact factor: 47.728

10.  Optical studies of solid hydrogen to 320 GPa and evidence for black hydrogen.

Authors:  Paul Loubeyre; Florent Occelli; René LeToullec
Journal:  Nature       Date:  2002-04-11       Impact factor: 49.962

View more
  12 in total

1.  The insulator-metal transition in hydrogen.

Authors:  Isaac Silvera
Journal:  Proc Natl Acad Sci U S A       Date:  2010-07-19       Impact factor: 11.205

2.  Evidence for a first-order liquid-liquid transition in high-pressure hydrogen from ab initio simulations.

Authors:  Miguel A Morales; Carlo Pierleoni; Eric Schwegler; D M Ceperley
Journal:  Proc Natl Acad Sci U S A       Date:  2010-06-21       Impact factor: 11.205

3.  Illuminating liquid polymorphism in silicon.

Authors:  Srikanth Sastry
Journal:  Proc Natl Acad Sci U S A       Date:  2010-09-27       Impact factor: 11.205

4.  Bonding changes in hot fluid hydrogen at megabar pressures.

Authors:  Natarajan Subramanian; Alexander F Goncharov; Viktor V Struzhkin; Maddury Somayazulu; Russell J Hemley
Journal:  Proc Natl Acad Sci U S A       Date:  2011-03-29       Impact factor: 11.205

5.  Evidence of a liquid-liquid phase transition in hot dense hydrogen.

Authors:  Vasily Dzyabura; Mohamed Zaghoo; Isaac F Silvera
Journal:  Proc Natl Acad Sci U S A       Date:  2013-04-29       Impact factor: 11.205

6.  Liquid-liquid phase transition in hydrogen by coupled electron-ion Monte Carlo simulations.

Authors:  Carlo Pierleoni; Miguel A Morales; Giovanni Rillo; Markus Holzmann; David M Ceperley
Journal:  Proc Natl Acad Sci U S A       Date:  2016-04-20       Impact factor: 11.205

7.  Nuclear quantum effects on the dynamics and glass behavior of a monatomic liquid with two liquid states.

Authors:  Ali Eltareb; Gustavo E Lopez; Nicolas Giovambattista
Journal:  J Chem Phys       Date:  2022-05-28       Impact factor: 4.304

8.  Stability of dense liquid carbon dioxide.

Authors:  Brian Boates; Amanuel M Teweldeberhan; Stanimir A Bonev
Journal:  Proc Natl Acad Sci U S A       Date:  2012-08-20       Impact factor: 11.205

9.  Critical behavior of a water monolayer under hydrophobic confinement.

Authors:  Valentino Bianco; Giancarlo Franzese
Journal:  Sci Rep       Date:  2014-04-04       Impact factor: 4.379

10.  Unexpectedly high pressure for molecular dissociation in liquid hydrogen by electronic simulation.

Authors:  Guglielmo Mazzola; Seiji Yunoki; Sandro Sorella
Journal:  Nat Commun       Date:  2014-03-19       Impact factor: 14.919

View more

北京卡尤迪生物科技股份有限公司 © 2022-2023.