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Volumn 20, Issue 2, 2004, Pages 514-523

Lattice Monte Carlo Simulations of Phase Separation and Micellization in Supercritical CO 2Surfactant Systems: Effect of CO 2 Density

Author keywords

[No Author keywords available]

Indexed keywords

FLUORINATION; INTERACTION ENERGY; PHASE BEHAVIORS;

EID: 0742269483     PISSN: 07437463     EISSN: None     Source Type: Journal    
DOI: 10.1021/la0347760     Document Type: Article
Times cited : (29)

References (49)
  • 1
    • 0026907669 scopus 로고
    • Synthesis of fluoropolymers in supercritical carbon dioxide
    • DeSimone, J. M.; Guan Z.; Eisbernd C. S. Synthesis of fluoropolymers in supercritical carbon dioxide. Science 1992, 257 (5072), 945-947.
    • (1992) Science , vol.257 , Issue.5072 , pp. 945-947
    • Desimone, J.M.1    Guan, Z.2    Eisbernd, C.S.3
  • 3
    • 0033501538 scopus 로고    scopus 로고
    • Polymer Coatings by Rapid Expansion of Suspensions in Supercritical Carbon Dioxide
    • Shim, J.-J.; Yates, M. Z.; Johnston, K. P. Polymer Coatings by Rapid Expansion of Suspensions in Supercritical Carbon Dioxide. Ind. Eng. Chem. Res. 1999, 38 (10), 3655-3662.
    • (1999) Ind. Eng. Chem. Res. , vol.38 , Issue.10 , pp. 3655-3662
    • Shim, J.-J.1    Yates, M.Z.2    Johnston, K.P.3
  • 7
    • 0033134249 scopus 로고    scopus 로고
    • Opportunities for process intensification using reverse micelles in liquid and supercritical carbon dioxide
    • Goetheer E. L. V.; Vorstman M. A. G.; Keurentjes, J. T. F. Opportunities for process intensification using reverse micelles in liquid and supercritical carbon dioxide. Chem. Eng. Sci. 1999, 54 (10), 1589-1596.
    • (1999) Chem. Eng. Sci. , vol.54 , Issue.10 , pp. 1589-1596
    • Goetheer, E.L.V.1    Vorstman, M.A.G.2    Keurentjes, J.T.F.3
  • 9
    • 0027541936 scopus 로고
    • Design and synthesis of highly carbon dioxide-soluble surfactants and chelating agents
    • Hoefling, T. A.; Beitle, E. R.; Enick, R. M.; Beckman, E. J. Design and synthesis of highly carbon dioxide-soluble surfactants and chelating agents. Fluid Phase Equilib. 1993, 83, 203-212.
    • (1993) Fluid Phase Equilib. , vol.83 , pp. 203-212
    • Hoefling, T.A.1    Beitle, E.R.2    Enick, R.M.3    Beckman, E.J.4
  • 12
    • 0037080927 scopus 로고    scopus 로고
    • Self-assembly of surfactants in a supercritical solvent from lattice Monte Carlo simulations
    • Lisal, M.; Hall, C. K.; Gubbins, K. E.; Panagiotopoulos, A. Z. Self-assembly of surfactants in a supercritical solvent from lattice Monte Carlo simulations. J. Chem. Phys. 2002, 116 (3), 1171-1184.
    • (2002) J. Chem. Phys. , vol.116 , Issue.3 , pp. 1171-1184
    • Lisal, M.1    Hall, C.K.2    Gubbins, K.E.3    Panagiotopoulos, A.Z.4
  • 13
    • 0037196743 scopus 로고    scopus 로고
    • Micellar behavior in a supercritical solvent-surfactant from lattice Monte Carlo simulations
    • Lisal, M.; Hall, C. K.; Gubbins, K. E.; Panagiotopoulos, A. Z. Micellar behavior in a supercritical solvent-surfactant from lattice Monte Carlo simulations. Fluid Phase Equilib. 2002, 194, 233-247.
    • (2002) Fluid Phase Equilib. , vol.194 , pp. 233-247
    • Lisal, M.1    Hall, C.K.2    Gubbins, K.E.3    Panagiotopoulos, A.Z.4
  • 15
    • 0032661853 scopus 로고    scopus 로고
    • Self-Assembly of Reverse Micelles in Water/Surfactant/Carbon Dioxide Systems by Molecular Simulation
    • Salaniwal, S.; Cui S. T.: Cummings, P. T.; Cochran, H. D. Self-Assembly of Reverse Micelles in Water/Surfactant/Carbon Dioxide Systems by Molecular Simulation. Langmuir 1999, 15 (16), 5188-5192.
    • (1999) Langmuir , vol.15 , Issue.16 , pp. 5188-5192
    • Salaniwal, S.1    Cui, S.T.2    Cummings, P.T.3    Cochran, H.D.4
  • 16
    • 0034397523 scopus 로고    scopus 로고
    • Molecular Dynamics Simulation of Reverse Micelles in Supercritical Carbon Dioxide
    • Salaniwal, S.; Cui, S.; Cochran, H. D.; Cummings, P. T. Molecular Dynamics Simulation of Reverse Micelles in Supercritical Carbon Dioxide. Ind. Eng. Chem. Res. 2000, 39 (12), 4543-4554.
    • (2000) Ind. Eng. Chem. Res. , vol.39 , Issue.12 , pp. 4543-4554
    • Salaniwal, S.1    Cui, S.2    Cochran, H.D.3    Cummings, P.T.4
  • 17
    • 0037196835 scopus 로고    scopus 로고
    • Phase behavior of PVAC-PTAN block copolymer in supercritical carbon dioxide using SAFT
    • Colina, C. M.; Hall, C. K.; Gubbins, K. E. Phase behavior of PVAC-PTAN block copolymer in supercritical carbon dioxide using SAFT. Fluid Phase Equilib. 2002, 194-197, 553-565.
    • (2002) Fluid Phase Equilib. , vol.194-197 , pp. 553-565
    • Colina, C.M.1    Hall, C.K.2    Gubbins, K.E.3
  • 19
    • 11144344122 scopus 로고
    • Monte Carlo simulation of model amphiphile-oil-water systems
    • Larson, R. G.; Scriven, L. E.; Davis, H. T. Monte Carlo simulation of model amphiphile-oil-water systems. J. Chem. Phys. 1985, 83, 2411-2420.
    • (1985) J. Chem. Phys. , vol.83 , pp. 2411-2420
    • Larson, R.G.1    Scriven, L.E.2    Davis, H.T.3
  • 21
    • 0033279203 scopus 로고    scopus 로고
    • Micellization in Model Surfactant Systems
    • Floriano, M. A.; Caponetti, E.; Panagiotopoulos, A. Z. Micellization in Model Surfactant Systems. Langmuir 1999, 15 (9), 3143-3151.
    • (1999) Langmuir , vol.15 , Issue.9 , pp. 3143-3151
    • Floriano, M.A.1    Caponetti, E.2    Panagiotopoulos, A.Z.3
  • 22
    • 0000592329 scopus 로고    scopus 로고
    • Phase equilibria of a lattice model for an oil - Water-amphiphile mixture
    • Mackie, A. D.; Onur, K.; Panagiotopoulos, A. Z. Phase equilibria of a lattice model for an oil - water-amphiphile mixture. J. Chem. Phys. 1996, 104(10), 3718-3725.
    • (1996) J. Chem. Phys. , vol.104 , Issue.10 , pp. 3718-3725
    • Mackie, A.D.1    Onur, K.2    Panagiotopoulos, A.Z.3
  • 23
    • 0031234054 scopus 로고    scopus 로고
    • Aggregation behavior of a lattice model for amphiphiles
    • Mackie, A. D.; Panagiotopoulos, A. Z.; Szleifer, I. Aggregation behavior of a lattice model for amphiphiles. Langmuir 1997, 13, 5022-5031.
    • (1997) Langmuir , vol.13 , pp. 5022-5031
    • Mackie, A.D.1    Panagiotopoulos, A.Z.2    Szleifer, I.3
  • 24
    • 36549097755 scopus 로고
    • Monte Carlo lattice simulation of amphiphilic systems in two and three dimensions
    • Larson, R. G. Monte Carlo lattice simulation of amphiphilic systems in two and three dimensions. J. Chem. Phys. 1988, 89 (3), 1642-1650.
    • (1988) J. Chem. Phys. , vol.89 , Issue.3 , pp. 1642-1650
    • Larson, R.G.1
  • 25
    • 36549101980 scopus 로고
    • Self-assembly of surfactant liquid crystalline phases by Monte Carlo simulation
    • Larson, R. G. Self-assembly of surfactant liquid crystalline phases by Monte Carlo simulation. J. Chem. Phys. 1989, 91 (4), 2479-2488.
    • (1989) J. Chem. Phys. , vol.91 , Issue.4 , pp. 2479-2488
    • Larson, R.G.1
  • 26
    • 0000257569 scopus 로고
    • Monte Carlo simulation of microstructural transitions in surfactant systems
    • Larson, R. G. Monte Carlo simulation of microstructural transitions in surfactant systems. J. Chem. Phys. 1992, 96, 7904-7918.
    • (1992) J. Chem. Phys. , vol.96 , pp. 7904-7918
    • Larson, R.G.1
  • 27
    • 0030263269 scopus 로고    scopus 로고
    • Monte Carlo simulations of the Phase Behavior of Surfactant Solutions
    • Larson, R. G. Monte Carlo simulations of the Phase Behavior of Surfactant Solutions. J. Phys. II 1996, 6, 1441-1463.
    • (1996) J. Phys. II , vol.6 , pp. 1441-1463
    • Larson, R.G.1
  • 28
    • 0000439314 scopus 로고    scopus 로고
    • A Monte Carlo simulation of the micellar phase of an amphiphile and solvent mixture
    • Desplat, J. C.; Care, C. M. A Monte Carlo simulation of the micellar phase of an amphiphile and solvent mixture. Mol. Phys. 1996, 87 (2), 441-453.
    • (1996) Mol. Phys. , vol.87 , Issue.2 , pp. 441-453
    • Desplat, J.C.1    Care, C.M.2
  • 29
    • 0001722393 scopus 로고    scopus 로고
    • On the size and shape of self-assembled micelles
    • Nelson, P. H.; Rutledge G. C.; Hatton, T. A. On the size and shape of self-assembled micelles. J. Chem. Phys. 1997, 107(24), 10777-10781.
    • (1997) J. Chem. Phys. , vol.107 , Issue.24 , pp. 10777-10781
    • Nelson, P.H.1    Rutledge, G.C.2    Hatton, T.A.3
  • 30
    • 0032761589 scopus 로고    scopus 로고
    • Thermodynamics of Aggregation of Amphiphiles in Solution from Lattice Monte Carlo Simulations
    • Rodriguez-Guadarrama, L. A.; Talsania, S. K.; Mohanty, K. K.; Rajagopalan, R. Thermodynamics of Aggregation of Amphiphiles in Solution from Lattice Monte Carlo Simulations. Langmuir 1999, 15 (2), 437-446.
    • (1999) Langmuir , vol.15 , Issue.2 , pp. 437-446
    • Rodriguez-Guadarrama, L.A.1    Talsania, S.K.2    Mohanty, K.K.3    Rajagopalan, R.4
  • 31
    • 0037007371 scopus 로고    scopus 로고
    • Micellization and phase separation of diblock and triblock model surfactants
    • Panagiotopoulos, A. Z.; Floriano, M. A.; Kumar, S. K. Micellization and phase separation of diblock and triblock model surfactants. Langmuir 2002, 18 (7), 2940-2948.
    • (2002) Langmuir , vol.18 , Issue.7 , pp. 2940-2948
    • Panagiotopoulos, A.Z.1    Floriano, M.A.2    Kumar, S.K.3
  • 32
    • 0028496018 scopus 로고
    • Molecular simulation of ordered amphiphilic phases
    • Larson, R. G. Molecular simulation of ordered amphiphilic phases. Chem. Eng. Sci. 1994, 49 (17), 2833-2850.
    • (1994) Chem. Eng. Sci. , vol.49 , Issue.17 , pp. 2833-2850
    • Larson, R.G.1
  • 33
    • 0028416911 scopus 로고
    • A triangular lattice model for binary and ternary mixtures containing surfactants
    • Laradji, M.; Guo, H.; Zuckermann, M. J. A triangular lattice model for binary and ternary mixtures containing surfactants. J. Phys.: Condens. Matter 1994, 6, 2799-2812.
    • (1994) J. Phys.: Condens. Matter , vol.6 , pp. 2799-2812
    • Laradji, M.1    Guo, H.2    Zuckermann, M.J.3
  • 34
    • 0035887354 scopus 로고    scopus 로고
    • Critical micelle concentration in three-dimensional lattice models of amphiphiles
    • Bhattacharya, A.; Mahanti, S. D. Critical micelle concentration in three-dimensional lattice models of amphiphiles. J. Phys.: Condens. Matter 2001, 13 (41), L861-869.
    • (2001) J. Phys.: Condens. Matter , vol.13 , Issue.41
    • Bhattacharya, A.1    Mahanti, S.D.2
  • 35
    • 0037154568 scopus 로고    scopus 로고
    • A systematic Monte Carlo study of self-assembling amphiphiles in solution
    • Kenward, M.; Whitmore, M. D. A systematic Monte Carlo study of self-assembling amphiphiles in solution. J. Chem. Phys. 2002, 116 (8), 3455-3470.
    • (2002) J. Chem. Phys. , vol.116 , Issue.8 , pp. 3455-3470
    • Kenward, M.1    Whitmore, M.D.2
  • 37
    • 0032075651 scopus 로고    scopus 로고
    • Phase Behavior and Solubilization in Surfactant-Solute-Solvent Systems by Monte Carlo Simulations
    • Talsania, S. K.; Rodriguez-Guadarrama, L. A.; Mohanty, K. K.; Rajagopalan, R. Phase Behavior and Solubilization in Surfactant-Solute-Solvent Systems by Monte Carlo Simulations. Langmuir 1998, 14 (10), 2684-2692.
    • (1998) Langmuir , vol.14 , Issue.10 , pp. 2684-2692
    • Talsania, S.K.1    Rodriguez-Guadarrama, L.A.2    Mohanty, K.K.3    Rajagopalan, R.4
  • 38
    • 0032332962 scopus 로고    scopus 로고
    • Monte Carlo simulation of micelle formation in block copolymer solutions
    • Viduna, D.; Milchev, A.; Binder, K. Monte Carlo simulation of micelle formation in block copolymer solutions. Macromol. Theory Simul. 1998, 7, 649-658.
    • (1998) Macromol. Theory Simul. , vol.7 , pp. 649-658
    • Viduna, D.1    Milchev, A.2    Binder, K.3
  • 39
    • 78650612270 scopus 로고
    • Configurational bias Monte Carlo: A new sampling scheme for flexible chains
    • Siepmann, J.; Frenkel, D. Configurational bias Monte Carlo: a new sampling scheme for flexible chains. Mol. Phys. 1992, 75, 59-70.
    • (1992) Mol. Phys. , vol.75 , pp. 59-70
    • Siepmann, J.1    Frenkel, D.2
  • 40
    • 36849137515 scopus 로고
    • Monte Carlo calculation of the average extension of molecular chains
    • Rosenbluth, M. N.; Rosenbluth, A. W. Monte Carlo calculation of the average extension of molecular chains. J. Chem. Phys. 1955, 23, 356-359.
    • (1955) J. Chem. Phys. , vol.23 , pp. 356-359
    • Rosenbluth, M.N.1    Rosenbluth, A.W.2
  • 42
    • 0000350426 scopus 로고
    • Critical Micelle Concentration. A transition Point for Micellar Size Distribution
    • Ruckenstein, E.; Nagajaran, R. Critical Micelle Concentration. A transition Point for Micellar Size Distribution. J. Phys. Chem. 1975, 79 (24), 2622-2626.
    • (1975) J. Phys. Chem. , vol.79 , Issue.24 , pp. 2622-2626
    • Ruckenstein, E.1    Nagajaran, R.2
  • 43
    • 33750406161 scopus 로고
    • Theory of self-assembly of hydrocarbon amphiphiles into micelles and bilayers
    • Israelachvili, J. N.; Mitchell, D. J.; Ninham, B. W. Theory of self-assembly of hydrocarbon amphiphiles into micelles and bilayers. J. Chem. Soc., Faraday Trans. 1976, 2 (72), 1525-1568.
    • (1976) J. Chem. Soc., Faraday Trans. , vol.2 , Issue.72 , pp. 1525-1568
    • Israelachvili, J.N.1    Mitchell, D.J.2    Ninham, B.W.3
  • 47
    • 0032136741 scopus 로고    scopus 로고
    • Laser light scattering study of pressure-induced micellization of a diblock copolymer of poly(1,1-dihydroperfluorooctyl-acrylate) and poly(vinyl acetate) in supercritical carbon dioxide
    • Zhou, S.; Chu, B. Laser light scattering study of pressure-induced micellization of a diblock copolymer of poly(1,1-dihydroperfluorooctyl-acrylate) and poly(vinyl acetate) in supercritical carbon dioxide. Macromolecules 1998, 31, 5300-5308.
    • (1998) Macromolecules , vol.31 , pp. 5300-5308
    • Zhou, S.1    Chu, B.2


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