Phase transition properties of Bell-Lavis model
@article{imnas2014PhaseTP, title={Phase transition properties of Bell-Lavis model}, author={Mantas {\vS}imėnas and Andrius Ibenskas and Evaldas E. Tornau}, journal={arXiv: Statistical Mechanics}, year={2014} }
Using Monte Carlo calculations we analyze the order and the universality class of phase transitions into a low density (honeycomb) phase of a triangular antiferromagnetic three-state Bell-Lavis model. The results are obtained in a whole interval of chemical potential $\mu$ corresponding to the honeycomb phase. Our results demonstrate that the phase transitions might be attributed to the three-state Potts universality class for all $\mu$ values except for the edges of the honeycomb phase…
13 Citations
Effect of lattice coarsening and exclusion on phase-transition properties of the Bell–Lavis model
- PhysicsPhysical review. E, Statistical, nonlinear, and soft matter physics
- 2014
The temperature and order of the phase transition are studied for a less-coarsened Bell–Lavis model and the critical exponents obtained for the lower phase transition demonstrate the values typical for the three-state Potts model universality class.
Order-disorder transition in a two-dimensional associating lattice gas.
- PhysicsPhysical review. E
- 2019
This work studies an associating lattice gas (ALG) using Monte Carlo simulation on the triangular lattice and semianalytical solutions on Husimi lattices to find a discontinuous phase transition, characterized by a discontinuity of the nematic order parameter.
Assembly of trivalent particles under confinement: from an exotic solid phase to a liquid phase at low temperature.
- Physics, Materials ScienceSoft matter
- 2017
Using computer simulations, the phase diagram of a two-dimensional system of disk particles with three patches distributed symmetrically along the particle equator is studied and the effect of patch size within the single bond per patch regime is investigated.
Analyzing and validating simulated tempering implementations at phase transition regimes
- Computer ScienceComput. Phys. Commun.
- 2021
Coronene Molecules in Hexagonal Pores of Tricarboxylic Acids: A Monte Carlo Study
- Chemistry
- 2015
We propose a seven-state (orientation) model with some exclusions to describe the ordering of symmetry-reduced biphenyl-3,4′,5-tricarboxylic acid (BHTC) molecules into planar ordered structures on a…
Phase diagram and critical properties of a two-dimensional associating lattice gas
- PhysicsPhysical Review E
- 2021
gas I. Ibagon, a) A. P. Furlan, b) T. J. Oliveira, c) and R. Dickman d) Departamento de F́ısica, ICEx, Universidade Federal de Minas Gerais, C. P. 702, 30123-970, Belo Horizonte, Minas Gerais Brazil…
Three-Dimensional Model for Planar Assembly of Triangular Molecules: Effect of Substrate–Molecule Interaction
- Physics
- 2017
A three-dimensional (3D) model is proposed to study the self-assembly of triangular molecules at the solid–liquid interface and the effects of the surface–molecule interaction on molecular ordering.…
Thermodynamics, EOS, and heat capacity in molecular modeling of self-assembled molecular layers.
- ChemistryThe Journal of chemical physics
- 2020
This study presents results of molecular modeling of two-dimensional structures of tripod-shaped molecules associated with the trimesic acid (TMA) molecules using a recently developed method of external fields imposed on an elongated simulation cell in the framework of a kinetic Monte Carlo algorithm.