Liquid-vapor equilibrium and interfacial properties of square wells in two dimensions

• Published in: The Journal of chemical physics 2013-01, Vol.138 (4), p.044508-044508
• Main Authors: Armas-Pérez, Julio C, Quintana-H, Jacqueline, Chapela, Gustavo A
• Format: Article
• Language: English
• Subjects: Corresponding states; Density; Interfacial properties; Liquids; Square wells; Surface tension; Two dimensional; Vapor pressure
• ISSN: 0021-9606; 1089-7690
• DOI: 10.1063/1.4775342

Liquid-vapor coexistence and interfacial properties of square wells in two dimensions are calculated. Orthobaric densities, vapor pressures, surface tensions, and interfacial thicknesses are reported. Results are presented for a series of potential widths λ* = 1.4, 1.5, 2, 2.5, 3, 3.5, 4, 4.5, and 5, where λ* is given in units of the hard core diameter σ. Critical and triple points are explored. No critical point was found for λ* < 1.4. Corresponding states principle analysis is performed for the whole series. For λ* = 1.4 and 1.5 evidence is presented that at an intermediate temperature between the critical and the triple point temperatures the liquid branch becomes an amorphous solid. This point is recognized in Armas-Pérez et al. [unpublished] as a hexatic phase transition. It is located at reduced temperatures T* = 0.47 and 0.35 for λ* = 1.4 and 1.5, respectively. Properties such as the surface tension, vapor pressure, and interfacial thickness do not present any discontinuity at these points. This amorphous solid branch does not follow the corresponding state principle, which is only applied to liquids and gases.