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Extended law of corresponding states: square-well oblates

Santiago, Miguel Gomez and Gurin, Péter and Varga, Szabolcs and Odriozola, Gerardo (2022) Extended law of corresponding states: square-well oblates. JOURNAL OF PHYSICS: CONDENSED MATTER. ISSN 0953-8984 (print); 1361-648X (online)

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Abstract

The vapour–liquid coexistence collapse in the reduced temperature, T r = T/T c , reduced density, ρ r = ρ/ρ c , plane is known as a principle of corresponding states, and Noro and Frenkel have extended it for pair potentials of variable range. Here, we provide a theoretical basis supporting this extension, and show that it can also be applied to short-range pair potentials where both repulsive and attractive parts can be anisotropic. We observe that the binodals of oblate hard ellipsoids for a given aspect ratio (κ = 1/3) with varying short-range square-well interactions collapse into a single master curve in the ΔB ∗ 2 –ρ r plane, where ΔB ∗ 2 = (B 2 (T) − B 2 (T c ))/v 0 , B 2 is the second virial coefficient, and v 0 is the volume of the hard body. This finding is confirmed by both REMC simulation and second virial perturbation theory for varying square-well shells, mimicking uniform, equator, and pole attractions. Our simulation results reveal that the extended law of corresponding states is not related to the local structure of the fluid.

Item Type: Article
Subjects: Q Science / természettudomány > QC Physics / fizika > QC03 Heat. Thermodinamics / hőtan, termodinamika
Q Science / természettudomány > QC Physics / fizika > QC06 Physics of condensed matter / szilárdtestfizika
Q Science / természettudomány > QD Chemistry / kémia
Q Science / természettudomány > QD Chemistry / kémia > QD02 Physical chemistry / fizikai kémia
Depositing User: Professor Dezső Boda
Date Deposited: 09 Nov 2023 16:01
Last Modified: 09 Nov 2023 16:01
URI: http://real.mtak.hu/id/eprint/179457

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