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Volumetric properties of gas mixtures containing one or more polar components
Author(s) -
Blanks R. F.,
Prausnitz J. M.
Publication year - 1962
Publication title -
aiche journal
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.958
H-Index - 167
eISSN - 1547-5905
pISSN - 0001-1541
DOI - 10.1002/aic.690080121
Subject(s) - polar , chemical polarity , virial coefficient , dipole , chemistry , component (thermodynamics) , moment (physics) , thermodynamics , molecule , london dispersion force , binary number , enthalpy , dispersion (optics) , van der waals force , physics , classical mechanics , organic chemistry , mathematics , optics , quantum mechanics , arithmetic
A study has been made of the second virial coefficients of binary gas mixtures containing one or two polar components. Methods for calculating these coefficients are presented. The interaction coefficient B ij for a polar‐polar interaction cannot be calculated with the Stockmayer potential with pure component parameters only; such calculations tend to underestimate the strong forces of attraction between dissimilar polar molecules. It is shown that the characteristic distance for the reduced dipole moment for two dissimilar polar molecules is less than the arithmetic average of the distance parameter of the similar molecules by an amount which can be related to the enthalpy of complex formation. When this corrected collision diameter is used in the Stockmayer potential, good results can be obtained for interaction coefficient B ij . In the case of a polar‐nonpolar mixture the coefficient B ij depends on dispersion and on induction forces. Techniques are proposed for estimating these forces from pure component parameters, and it is shown that for accurate calculation of B ij it is necessary to correct for the displacement of the dipole from the center of the polar molecule. The paper concludes with some illustrations of how these ideas may be applied to typical chemical engineering problems.