Solid-liquid coexistence of the noble elements. II. Neon, krypton and xenon
arXiv:2006.07097 · doi:10.1063/5.0045398
Abstract
The noble elements constitute the simplest group in the periodic table. At low temperatures or high pressures, the liquid phase solidifies into a face-centered cubic crystal structure (except helium). In the companion paper, we investigated the fcc solid-liquid coexistence of argon in the light of hidden scale invariance. Here we extend the investigation to neon, argon, krypton, and xenon. Computations are done using the SAAP potential, suggested by Deiters and Sadus [J. Chem. Phys 150, 134504 (2019)], derived from accurate ab initio calculations. The systems exhibit hidden scale invariance in the investigated part of the phase diagram, which makes it possible to predict the shape and property variations along the solid-liquid coexistence lines.
References in corpus (22)
- Ab initio thermodynamics of liquid and solid water
- "Isomorphs" in liquid state diagrams
- Pressure-energy correlations in liquids. IV. "Isomorphs" in liquid state diagrams
- Thermodynamical Scaling of the Glass Transition Dynamics
- Scaling out the density dependence of the relaxation in glassforming polymers
- Thermodynamic interpretation of the scaling of the dynamics of supercooled liquids
- Strong pressure-energy correlations in van der Waals liquids
- Simplicity of condensed matter at its core: Generic definition of a Roskilde-simple system
- Probing the link between residual entropy and viscosity of molecular fluids and model potentials
- RUMD: A general purpose molecular dynamics package optimized to utilize GPU hardware down to a few thousand particles
- Computing Gibbs free energy differences by interface pinning
- Explaining why simple liquids are quasi-universal
- How short-range attractions impact the structural order, self-diffusivity, and viscosity of a fluid
- Hidden scale invariance of metals
- Estimating the density-scaling exponent of a monatomic liquid from its pair potential
- Experimental evidence of a state-point dependent scaling exponent of liquid dynamics
- The EXP pair-potential system. II. Fluid phase isomorphs
- The EXP pair-potential system. I. Fluid phase isotherms, isochores, and quasiuniversality
- Intermolecular distance and density scaling of dynamics in molecular liquids
- Computing the crystal growth rate by the interface pinning method
- Hidden scale invariance at high pressures in gold and five other fcc metal crystals
- The FCC-BCC-Fluid triple point for model pair interactions with variable softness
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- Freezing density scaling of fluid transport properties: Application to liquefied noble gases
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- Optical and spin-coherence properties of rubidium atoms trapped in solid neon
- Estimating melting curves for Cu and Al from simulations at a single state point
- Isomorphs in sheared binary Lennard-Jones glass: Transient response