Hard core lattice gas with third next-nearest neighbor exclusion on triangular lattice: One or two phase transitions?

• Published in: The Journal of chemical physics Vol. 155; no. 22; p. 224101
• Main Authors: Jaleel, Asweel Ahmed A, Mandal, Dipanjan, Rajesh, R
• Format: Journal Article
• Language: English
• Published: United States 14.12.2021
• ISSN: 1089-7690
• DOI: 10.1063/5.0066098

We obtain the phase diagram of the hard core lattice gas with third nearest neighbor exclusion on the triangular lattice using Monte Carlo simulations that are based on a rejection-free flat histogram algorithm. In a recent paper [Darjani et al., J. Chem. Phys. 151, 104702 (2019)], it was claimed that the lattice gas with third nearest neighbor exclusion undergoes two phase transitions with increasing density with the phase at intermediate densities exhibiting hexatic order with continuously varying exponents. Although a hexatic phase is expected when the exclusion range is large, it has not been seen earlier in hard core lattice gases with short range exclusion. In this paper, by numerically determining the entropies for all densities, we show that there is only a single phase transition in the system between a low-density fluid phase and a high density ordered sublattice phase and that a hexatic phase is absent. The transition is shown to be first order in nature, and the critical parameters are determined accurately.