Litcius/Paper detail

Liquid-hexatic transition for soft disks

Yoshihiko Nishikawa, Werner Krauth, A. C. Maggs

2023Physical review. E11 citationsDOIOpen Access PDF

Abstract

We study the liquid-hexatic transition of soft disks with massively parallel simulations and determine the equation of state as a function of system size. For systems with interactions decaying as the inverse mth power of the separation, the liquid-hexatic phase transition is continuous for m=12 and m=8, while it is of first order for m=24. The critical power m for the transition between continuous and first-order behavior is larger than previously reported. The continuous transition for m=12 implies that the two-dimensional Lennard-Jones model has a continuous liquid-hexatic transition at high temperatures. We also study the Weeks-Chandler-Andersen model and find a continuous transition at high temperatures that is consistent with the soft-disk case for m=12. Pressure data as well as our implementation are available from an open-source repository.

Topics & Concepts

Phase transitionInversePhysicsLiquid liquidMaterials scienceCondensed matter physicsStatistical physicsThermodynamicsChemistryMathematicsChromatographyGeometryTheoretical and Computational PhysicsMaterial Dynamics and PropertiesPhase Equilibria and Thermodynamics