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A modified square well model in obtaining the surface tension of pure and binary mixtures of hydrocarbons

Bitaab, A ; Sharif University of Technology | 2008

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  1. Type of Document: Article
  2. DOI: 10.1016/j.jct.2008.02.014
  3. Publisher: 2008
  4. Abstract:
  5. A model based on the perturbation theory of fluids was proposed to correlate the experimental data for surface tension of pure hydrocarbons in a wide range of temperature. The results obtained for the pure hydrocarbons were directly used to predict the surface tension for binary hydrocarbon mixtures at various temperatures. In the proposed model, a modified form of the square well potential energy between the molecules of the reference fluid was taken into account while the Lennard-Jones dispersion energy was considered to be dominant amongst the molecules as the perturbed term to the reference part of the model. In general, the proposed model has three adjustable parameters which are chain length, m, size, σ, and energy, ε/κ, parameters, but in some cases the number of parameters was reduced to two, thereby setting the chain length to be unity for pure hydrocarbons. The regressed values of these parameters were obtained using the experimental data for pure hydrocarbons at different temperatures. The results showed that these parameters can be related to the molar mass of hydrocarbons. The model was also extended to predict the surface tension of binary hydrocarbon mixtures using the parameters obtained for the pure compounds. It is worth noting that no additional parameter has been introduced into the model in the extension of the model to the mixtures studied in this work. The results showed that the proposed model can accurately correlate the surface tension of pure hydrocarbons. Also the results showed that the surface tension for binary mixture of hydrocarbons can be accurately predicted using the proposed model over a wide temperature range. © 2008 Elsevier Ltd. All rights reserved
  6. Keywords:
  7. Binary mixtures ; Mathematical models ; Molar mass ; Potential energy ; Surface tension ; Binary hydrocarbon mixtures ; Dispersion energy ; Square well potential ; Hydrocarbons
  8. Source: Journal of Chemical Thermodynamics ; Volume 40, Issue 7 , 2008 , Pages 1131-1135 ; 00219614 (ISSN)
  9. URL: https://www.sciencedirect.com/science/article/abs/pii/S0021961408000505