TPT coefficients for cylindrical and spherocylindrical molecules

dc.contributorFranco, Luís Fernando Mercier
dc.creatorSouza, Nathan Barros de
dc.creatorLopes, Joyce Tavares
dc.creatorFranco, Luís Fernando Mercier
dc.date.accessioned2022-12-16T13:22:24Z
dc.date.available2022-12-16T13:22:24Z
dc.identifierhttps://doi.org/10.25824/redu/OCYCOL
dc.identifier.urihttps://repositorioslatinoamericanos.uchile.cl/handle/2250/5363124
dc.descriptionThis data set comprises calculated values of the perturbed Helmholtz free energy coefficients, considering both cylinders and spherocylinders as the reference term and an attractive spherically symmetric square-well potential as the perturbed term. Also, in the case of spherocylinders, data for a Kihara potential are reported. All the calculations were performed with Monte Carlo simulations.
dc.publisherRepositório de Dados de Pesquisa da Unicamp
dc.subjectEngineering
dc.subjectStatistical mechanics
dc.subjectPerturbation theory
dc.subjectMonte Carlo simulations
dc.subjectNon-spherical particles
dc.titleTPT coefficients for cylindrical and spherocylindrical molecules


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