Hydrogen-Helium Mixtures in the Interiors of Giant Planets
arXiv:cond-mat/0609476 · doi:10.1103/PhysRevB.75.024206
Abstract
Equilibrium properties of hydrogen-helium mixtures under conditions similar to the interior of giant gas planets are studied by means of first principle density functional molecular dynamics simulations. We investigate the molecular and atomic fluid phase of hydrogen with and without the presence of helium for densities between gcm and gcm and temperatures from K to . Helium has a crucial influence on the ionic and electronic structure of the liquid. Hydrogen molecule bonds are shortened as well as strengthened which leads to more stable hydrogen molecules compared to pure hydrogen for the same thermodynamic conditions. The {\it ab initio} treatment of the mixture enables us to investigate the validity of the widely used linear mixing approximation. We find deviations of up to 8% in energy and volume from linear mixing at constant pressure in the region of molecular dissociation.
arXiv comment13 pages, 18 figures, submitted to PRB
References in corpus (17)
- Ab initio pseudopotentials for electronic structure calculations of poly-atomic systems using density-functional theory
- Shock Compression of Deuterium and the Interiors of Jupiter and Saturn
- A quantum fluid of metallic hydrogen suggested by first-principles calculations
- Path Integral Monte Carlo Calculation of the Deuterium Hugoniot
- Molecular Dissociation in Hot, Dense Hydrogen
- A theoretical look at the direct detection of giant planets outside the Solar System
- First Principles Calculations of Shock Compressed Fluid Helium
- Calculation of a Deuterium Double Shock Hugoniot from Ab initio Simulations
- Coupled Electron Ion Monte Carlo Calculations of Dense Metallic Hydrogen
- Monte Carlo results for the hydrogen Hugoniot
- Simulations of Dense Atomic Hydrogen in the Wigner Crystal Phase
- Statistical Properties of the Dense Hydrogen Plasma: an ab initio Molecular Dynamics Investigation
- Free-energy model for fluid helium at high density
- Insulator-metal transition in solid hydrogen: Implication of electronic structure calculations for recent experiments
- The Equation of State and the Hugoniot of Laser Shock-Compressed Deuterium
- Hydrogen-Helium Mixtures at High Pressure
- Microcanonical calculations of excess thermodynamic properties of dense binary systems
Cited by in corpus (87)
- Comparing Jupiter interior structure models to Juno gravity measurements and the role of a dilute core
- The Interior Structure, Composition, and Evolution of Giant Planets
- The Uniform Electron Gas at Warm Dense Matter Conditions
- Ab initio Equation of State data for hydrogen, helium, and water and the internal structure of Jupiter
- A Massive Core in Jupiter Predicted From First-Principles Simulations
- Thermophysical properties of warm dense hydrogen
- Jupiter models with improved ab initio hydrogen EOS (H-REOS.2)
- Ab initio simulation of warm dense matter
- Ab Initio Equation of State for Hydrogen-Helium Mixtures with Recalibration of the Giant-Planet Mass-Radius Relation
- Evidence for supercritical behavior of high-pressure liquid hydrogen
- \textit{Ab Initio} Path Integral Monte Carlo Results for the Dynamic Structure Factor of Correlated Electrons: From the Electron Liquid to Warm Dense Matter
- Current challenges in the physics of white dwarf stars
- The Fermion Sign Problem in Path Integral Monte Carlo Simulations: Quantum Dots, Ultracold Atoms, and Warm Dense Matter
- Phase separation in hydrogen-helium mixtures at Mbar pressures
- First-Principles Equation of State Database for Warm Dense Matter Computation
- Structure and phase boundaries of compressed liquid hydrogen
- A Preliminary Jupiter Model
- The Static Local Field Correction of the Warm Dense Electron Gas: An ab Initio Path Integral Monte Carlo Study and Machine Learning Representation
- Electronic Density Response of Warm Dense Matter
- Phase diagram of hydrogen and a hydrogen-helium mixture at planetary conditions by Quantum Monte Carlo simulations
- Effective Static Approximation: A Fast and Reliable Tool for Warm Dense Matter Theory
- Ab Initio Path Integral Monte Carlo Approach to the Static and Dynamic Density Response of the Uniform Electron Gas
- First principles simulations of dense hydrogen
- A new equation of state for dense hydrogen-helium mixtures II: taking into account hydrogen-helium interactions
- A New Generation of Cool White Dwarf Atmosphere Models. IV. Revisiting the Spectral Evolution of Cool White Dwarfs
- Equation of state of metallic hydrogen from Coupled Electron-Ion Monte Carlo simulations
- Planetary Ices and the Linear Mixing Approximation
- Understanding Jupiter's Interior
- Unexpectedly high pressure for molecular dissociation in liquid hydrogen by a reliable electronic simulation
- Giant Planets
- Quantum molecular dynamics simulations for the nonmetal-to-metal transition in fluid helium
- Influence of finite temperature Exchange-Correlation effects in Hydrogen
- Models of Saturn's Interior Constructed with Accelerated Concentric Maclaurin Spheroid Method
- Accelerating Finite-temperature Kohn-Sham Density Functional Theory with Deep Neural Networks
- The Strongly Coupled Electron Liquid: ab initio Path Integral Monte Carlo Simulations and Dielectric Theories
- Dynamic properties of the warm dense electron gas: an ab initio path integral Monte Carlo approach
- Path Integral Monte Carlo Simulation of Degenerate Electrons: Permutation-Cycle Properties
- Density Response of the Warm Dense Electron Gas beyond Linear Response Theory: Excitation of Harmonics
- Ab initio path integral Monte Carlo approach to the momentum distribution of the uniform electron gas at finite temperature without fixed nodes
- Restricted configuration path integral Monte Carlo
- First-principles modeling of plasmons in aluminum under ambient and extreme conditions
- Properties of hydrogen, helium, and silicon dioxide mixtures in giant planet interiors
- X-ray scattering as a probe for warm dense mixtures and high-pressure miscibility
- Molecular-Atomic Transition in the Deuterium Hugoniot with Coupled Electron Ion Monte Carlo
- Path integral Monte Carlo simulations of dense carbon-hydrogen plasmas
- High pressure hydrogen by machine learning and quantum Monte Carlo
- Optical properties of high pressure liquid hydrogen across molecular dissociation
- Accounting for non-ideal mixing effects in the hydrogen-helium equation of state
- The equation of state of partially ionized hydrogen and deuterium plasma revisited
- Energy loss and friction characteristics of electrons at warm dense matter and non-ideal dense plasma conditions
- Benchmarking Exchange-Correlation Functionals in the Spin-Polarized Inhomogeneous Electron Gas under Warm Dense Conditions
- Effective electronic forces and potentials from ab initio path integral Monte Carlo simulations
- Plasma physics and planetary astrophysics
- Evolution of Jupiter and Saturn with helium rain
- Wide range equation of state for fluid hydrogen within density functional theory
- Evolutionary models for ultracool dwarfs
- Trial wave functions for High-Pressure Metallic Hydrogen
- Study of Jupiter's Interior: Comparison of 2, 3, 4, 5, and 6 Layer Models
- Shock Physics in Warm Dense Matter--a quantum hydrodynamics perspective
- Prediction of a roton-type feature in warm dense hydrogen
- Exchange-correlation effect in the charge response of a warm dense electron gas
- The properties of heavy elements in giant planet envelopes
- Nonlinear Density Response and Higher Order Correlation Functions in Warm Dense Matter
- Local structure in dense hydrogen at the liquid-liquid phase transition by Coupled Electron-Ion Monte Carlo
- On the Reactivity of Hydrogen-Helium and Hydrogen-Nitrogen at High Pressures
- Equilibrium Tidal Response of Jupiter: Detectability by Juno
- Quantum Langevin molecular dynamics determination of the solar-interior equation of state
- Relation of Gravity, Winds, and the Moment of Inertia of Jupiter and Saturn
- From Density Response to Energy Functionals and Back: An ab initio perspective on Matter Under Extreme Conditions
- Comparison of Jupiter Interior Models Derived from First-Principles Simulations
- Hydrogen and deuterium in shock wave experiments, ab initio simulations and chemical picture modeling
- Transport properties of dense deuterium-tritium plasmas
- Thermophysical properties of hydrogen-helium mixtures: Re-examination of the mixing rules via quantum molecular dynamics simulations
- Development of a new quantum trajectory molecular dynamics framework
- Hydrogen-Water Mixtures in Giant Planet Interiors Studied with Ab Initio Simulations
- Study of Jupiter's Interior with Quadratic Monte Carlo Simulations
- The Thermodynamical Instability Induced by Pressure Ionization in Fluid Helium
- Helium-hydrogen immiscibility at high pressures
- Nonlocal free-energy density functional for warm dense matter
- Electrical Conductivity of Warm Dense Hydrogen from Ohm's Law and Time-Dependent Density Functional Theory
- Quantum kinetic theory of light-matter interactions in degenerate plasmas
- Hydrogen liquid-liquid transition from first principles and machine learning
- Formation of H2-He substellar bodies in cold conditions: Gravitational stability of binary mixtures in a phase transition
- Accurate and thermodynamically consistent hydrogen equation of state for planetary modeling with flow matching
- Screened activity expansion for the pressure of a quantum multi-component plasma and consistency with the local charge neutrality
- Momentum distribution of the Uniform Electron Gas at finite temperature: Effects of spin-polarization
- Nonlinear electronic density response of the warm dense electron gas: multiple perturbations and mode coupling