Advanced search
Publication Cover
Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 66, 1989 - Issue 1
Submit an article Journal homepage
40
Views
43
CrossRef citations to date
0
Altmetric
Original Articles

Chemical potentials of model and real dense fluid mixtures from perturbation theory and simulations

Amal Lotfi Institut für Thermo- und Fluiddynamik, Ruhr-Universität, D-4630, Bochum, F.R. Germany
&
Johann Fischer Institut für Thermo- und Fluiddynamik, Ruhr-Universität, D-4630, Bochum, F.R. Germany
Pages 199-219 | Received 27 Jun 1988, Accepted 31 Aug 1988, Published online: 26 Oct 2007

Citations (43)

Keep up to date with the latest research on this topic with citation updates for this article.

Subscribe to citation updates

Read on this site (11)

Sascha Hempel, Jan Fischer, Dietmar Paschek & Gabriele Sadowski. (2012) Activity Coefficients of Complex Molecules by Molecular Simulation and Gibbs-Duhem Integration. Soft Materials 10:1-3, pages 26-41.
Read now
By TOMAS BOUBLIK. (1997) Phase equilibria of systems considered in supercritical fluid extraction determined from perturbation theory. Molecular Physics 90:4, pages 585-592.
Read now
G. T. GAO, J. B. WOLLER, X. C. ZENG & WENCHUAN WANG. (1997) Solute-solvent size ratio dependence of the solute residual chemical RESEARCH NOTE potential in subcritical solvents. Molecular Physics 90:1, pages 141-145.
Read now
C. G. JOSLIN, C. G. GRAY, S. GOLDMAN, B. TOMBERLI & W. LI. (1996) Solubilities in supercritical fluids from the virial equation of state. Molecular Physics 89:2, pages 489-503.
Read now
S. Toxvaerd & E. Velasco. (1995) Phase-stability lines, spinodals and distribution functions for binary immiscible mixtures. Molecular Physics 86:4, pages 845-855.
Read now
S. Toxvaerd. (1992) Distribution functions in liquid mixtures: molecular dynamics simulations and mean field theory. Molecular Physics 76:6, pages 1397-1409.
Read now
Amal Lotfi, Jadran Vrabec & Johann Fischer. (1992) Vapour liquid equilibria of the Lennard-Jones fluid from the NpT plus test particle method. Molecular Physics 76:6, pages 1319-1333.
Read now
Bohumil Tříska & Tomáš Boublík. (1992) The chemical potential of non-spherical solute in the infinitely diluted mixture. Molecular Physics 76:1, pages 113-125.
Read now
Dietmar Möller, Jörn Oprzynski & Johann Fischer. (1992) Thermodynamic properties of mixtures with linear molecules from WCA-type perturbation theory in comparison with MD results. Molecular Physics 75:6, pages 1455-1460.
Read now
ArielA. Chialvo & PabloG. Debenedetti. (1991) A Study of Solute-Solvent Interactions at Infinite Dilution via the Coupling Parameter Approach. Molecular Simulation 7:5-6, pages 265-283.
Read now
Dietmar Möller & Johann Fischer. (1990) Vapour liquid equilibrium of a pure fluid from test particle method in combination with NpT molecular dynamics simulations. Molecular Physics 69:3, pages 463-473.
Read now

Articles from other publishers (32)

Ariel A. Chialvo & Oscar D. Crisalle. (2019) On the behavior of the osmotic second virial coefficients of gases in aqueous solutions: Rigorous results, accurate approximations, and experimental evidence. The Journal of Chemical Physics 150:12.
Crossref
Ariel A. Chialvo. (2018) Gas solubility in dilute solutions: A novel molecular thermodynamic perspective. The Journal of Chemical Physics 148:17.
Crossref
Xin Liu, Sondre K. Schnell, Jean-Marc Simon, Peter Krüger, Dick Bedeaux, Signe Kjelstrup, André Bardow & Thijs J. H. Vlugt. (2013) Diffusion Coefficients from Molecular Dynamics Simulations in Binary and Ternary Mixtures. International Journal of Thermophysics 34:7, pages 1169-1196.
Crossref
Yow-Lin Huang, Svetlana Miroshnichenko, Hans Hasse & Jadran Vrabec. (2009) Henry’s Law Constant from Molecular Simulation: A Systematic Study of 95 Systems. International Journal of Thermophysics 30:6, pages 1791-1810.
Crossref
Shiqi Zhou & J. R. Solana. (2009) Progress in the Perturbation Approach in Fluid and Fluid-Related Theories. Chemical Reviews 109:6, pages 2829-2858.
Crossref
Yiping Tang & Benjamin C.-Y. Lu. (1998) Analytical equation of state for Lennard–Jones mixtures. Fluid Phase Equilibria 146:1-2, pages 73-92.
Crossref
Esam Z. Hamad. (1998) Exact limits of mixture properties and excess thermodynamic functions. Fluid Phase Equilibria 142:1-2, pages 163-184.
Crossref
H. Yuan, G.T. Gao & X.C. Zeng. (1997) Effects of the co-solvent energy parameter and dipolar strength on solute residual chemical potential. Fluid Phase Equilibria 138:1-2, pages 61-68.
Crossref
Jian Chen, Jiufang Lu & Yigui Li. (1997) A mixing rule for the size parameter from Carnahan-Starling equation and Boublik-Mansoori equation. Fluid Phase Equilibria 132:1-2, pages 169-186.
Crossref
K. Fotouh & K. Shukla. (1997) An improved perturbation theory and van der Waals one-fluid theory of binary fluid mixtures: Part 1. Total and excess thermodynamic properties. Fluid Phase Equilibria 127:1-2, pages 45-70.
Crossref
X.C. Zeng, J.W. Shen, H. Tanaka, K. Nakanishi & H. Yuan. (1996) Effects of solute size on the local solvent density and solute solubility in infinitely dilute supercritical solutions. Fluid Phase Equilibria 116:1-2, pages 296-303.
Crossref
Anping Liu & Thomas L. Beck. (1996) Methods of Single-Step and Multistep Particle Switching in Simulations of Mixtures. The Journal of Physical Chemistry 100:39, pages 16002-16005.
Crossref
Jadran Vrabec, Amal Lotfi & Johann Fischer. (1995) Vapour liquid equilibria of Lennard-Jones model mixtures from the NpT plus test particle method. Fluid Phase Equilibria 112:2, pages 173-197.
Crossref
Esam Z. Hamad. (1995) Consistent contact pair correlation functions and equations of state for hard-sphere mixture. The Journal of Chemical Physics 103:9, pages 3733-3736.
Crossref
Hung-chang Chiu & David A. Kofke. (1995) A theory for the 1-1/2 fluid. The Journal of Chemical Physics 103:4, pages 1599-1606.
Crossref
H. Tanaka, J.W. Shen, K. Nakanishi & X.C. Zeng. (1995) Integral equation and Monte Carlo simulation studies of clusters in infinitely dilute supercritical solutions. Chemical Physics Letters 239:1-3, pages 168-172.
Crossref
Esam Hamad. (1995) Thermodynamic Properties of Molecules Interacting with Inverse Power Potentials. Zeitschrift für Physikalische Chemie 190:2, pages 183-191.
Crossref
Esam Z. Hamad. (1994) Model for mixture pair correlation functions: Prediction of chemical potential at infinite dilution. Journal of Molecular Liquids 62:1-3, pages 123-138.
Crossref
Yoshimori Miyano. (1994) Equation of state calculations and Monte Carlo simulations of internal energies, compressibility factors and vapor-liquid equilibria for Lennard-Jones fluid mixtures. Fluid Phase Equilibria 95, pages 1-13.
Crossref
C. Vega, R. D. Kaminsky & P. A. Monson. (1993) Adsorption of fluids in disordered porous media from integral equation theory. The Journal of Chemical Physics 99:4, pages 3003-3013.
Crossref
Esam Hamad & G.Ali Mansoori. (1993) Theory of infinite dilution chemical potential. Fluid Phase Equilibria 85, pages 141-151.
Crossref
D. Ghonasgi, M. Llano-Restrepo & W. G. Chapman. (1993) Henry’s law constant for diatomic and polyatomic Lennard-Jones molecules. The Journal of Chemical Physics 98:7, pages 5662-5667.
Crossref
Ariel A. Chialvo. (1993) Accurate calculation of excess thermal, infinite dilution, and related properties of liquid mixtures via molecular-based simulation. Fluid Phase Equilibria 83, pages 23-32.
Crossref
Bohumil Tříska & Tomáš Boublík. (1992) Prediction of the Henry's law constant from the perturbation theory of mixtures of non-polar Kihara molecules. Fluid Phase Equilibria 78, pages 25-41.
Crossref
A.B Belonoshko & S.K Saxena. (1992) A unified equation of state for fluids of C-H-O-N-S-Ar composition and their mixtures up to very high temperatures and pressures. Geochimica et Cosmochimica Acta 56:10, pages 3611-3626.
Crossref
Dominique Levesque & Jean Jacques Weis. 1995. The Monte Carlo Method in Condensed Matter Physics. The Monte Carlo Method in Condensed Matter Physics 121 204 .
Keshawa P. Shukla. (1991) Phase equilibria and chemical potentials in infinite dilution of non-ideal fluid mixtures from perturbation theory. Fluid Phase Equilibria 67, pages 151-171.
Crossref
Yoshimon Miyano. (1991) Equation of state for Lennard-Jones fluid mixtures. Fluid Phase Equilibria 66:1-2, pages 125-141.
Crossref
David M. Pfund, Lloyd L. Lee & Henry D. Cochran. (1991) Chemical potentials from integral equations using scaled particle theory. II. Testing and applications. The Journal of Chemical Physics 94:4, pages 3114-3131.
Crossref
David M. Pfund, Lloyd L. Lee & Henry D. Cochran. (1991) Chemical potentials from integral equations using scaled particle theory. I. Theory. The Journal of Chemical Physics 94:4, pages 3107-3113.
Crossref
J. Fischer & M. Bohn. (1989) Effect of molecular shape on liquid mixture excess properties. Fluid Phase Equilibria 51, pages 245-255.
Crossref
Johann Fischer, Amal Lotfi, Klaus Lucas & Keshawa Prasad Shukla. (1989) On the importance of the first order blip expansion term in WCA-type perturbation theories. Fluid Phase Equilibria 47:2-3, pages 239-248.
Crossref

Reprints and Corporate Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

To request a reprint or corporate permissions for this article, please click on the relevant link below:

Order Reprints Request Corporate Permissions

Academic Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

Obtain permissions instantly via Rightslink by clicking on the button below:

Request Academic Permissions

If you are unable to obtain permissions via Rightslink, please complete and submit this Permissions form. For more information, please visit our Permissions help page.

Related research

People also read lists articles that other readers of this article have read.

Recommended articles lists articles that we recommend and is powered by our AI driven recommendation engine.

Cited by lists all citing articles based on Crossref citations.
Articles with the Crossref icon will open in a new tab.