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Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 30, 1975 - Issue 6
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Original Articles

Thermodynamics of mixtures of non-spherical molecules

II. Strong polar, quadrupolar, and overlap forces

, &
Pages 1649-1676 | Received 20 Mar 1975, Published online: 23 Aug 2006

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Ji[rbreve]Í Jane[cbreve]ek & Tomá[sbreve] BoublÍk. (2006) Monte Carlo study of dipolar and quadrupolar hard prolate spherocylinders. Molecular Physics 104:2, pages 197-210.
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PRASANNAK. JOG & W.G. CHAPMAN. (1999) Application of Wertheim's thermodynamic perturbation theory to dipolar hard sphere chains. Molecular Physics 97:3, pages 307-319.
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C.G. Gray, C.G. Joslin, V. Venkatasubramanian & K.E. Gubbins. (1985) Induction effects in fluid mixtures of dipolar-quadrupolar polarizable molecules. Molecular Physics 54:5, pages 1129-1148.
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V. Venkatasubramanian, K.E. Gubbins, C.G. Gray & C.G. Joslin. (1984) Induction effects in polar-polarizable liquid mixtures. Molecular Physics 52:6, pages 1411-1429.
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C.Y. TSANG, P. CLANCY, J.C.G. CALADO & W.B. STREETT. (1980) PHASE EQUILIBRIA IN THE H2/CH4 SYSTEM AT TEMPERATURES FROM 92.3 TO 180.0 K AND PRESSURES TO 140 MPa*. Chemical Engineering Communications 6:6, pages 365-383.
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J S Rowlinson & F L Swinton. 1982. Liquids and Liquid Mixtures. Liquids and Liquid Mixtures 230 278 .
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Friedrich Köhler. (2010) Molecular Theory of Liquid Mixtures. Berichte der Bunsengesellschaft für physikalische Chemie 81:10, pages 1037-1043.
Crossref
G. Stell & J. J. Weis. (1977) Pair correlation in simple polar liquids. Physical Review A 16:2, pages 757-765.
Crossref
Abdul K.M. Masood, Alastair M. North, Richard A. Pethrick, Matthew Towland & Findlay L. Swinton. (1977) Compressibility studies of benzene + hexafluorobenzene mixtures. The Journal of Chemical Thermodynamics 9:2, pages 133-137.
Crossref
Tomáš Boublík. (1977) Progress in statistical thermodynamics applied to fluid phase. Fluid Phase Equilibria 1:1, pages 37-87.
Crossref
J. M. Haile, C. G. Gray & K. E. Gubbins. (1976) Theory of surface tension for molecular liquids. II. Perturbation theory calculations. The Journal of Chemical Physics 64:6, pages 2569-2578.
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