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Volumn 22, Issue 4, 2005, Pages 512-520

Molecular dynamics simulation study of the effect of PMMA tacticity on free volume morphology in membranes

Author keywords

Accessible Free Volume; Free Volume Morphology; Pcff Force Field; PMMA Membrane; Tacticity

Indexed keywords


EID: 27144554925     PISSN: 02561115     EISSN: None     Source Type: Journal    
DOI: 10.1007/BF02706635     Document Type: Article
Times cited : (20)

References (32)
  • 1
    • 0016059519 scopus 로고
    • Effect of polymer microstructure on methyl group torsional vibrations
    • Allen, G., Wright, C. J. and Higgins, J. S., "Effect of Polymer Microstructure on Methyl Group Torsional Vibrations," Polymer, 15, 319 (1974).
    • (1974) Polymer , vol.15 , pp. 319
    • Allen, G.1    Wright, C.J.2    Higgins, J.S.3
  • 3
    • 0037520325 scopus 로고
    • Solvent effect on translational diffusivity and orientational mobility of polymers in solution: A molecular dynamics study
    • Bahar, I., Badur, B. and Doruker, P., "Solvent Effect on Translational Diffusivity and Orientational Mobility of Polymers in Solution: A Molecular Dynamics Study," J. Chem. Phys., 99, 2235 (1993).
    • (1993) J. Chem. Phys. , vol.99 , pp. 2235
    • Bahar, I.1    Badur, B.2    Doruker, P.3
  • 4
    • 36749120574 scopus 로고
    • Molecular dynamics study of a single polymer chain in solution
    • Bruns, W. and Bansal, R., "Molecular Dynamics Study of a Single Polymer Chain in Solution," J. Chem. Phys., 74, 2064 (1981).
    • (1981) J. Chem. Phys. , vol.74 , pp. 2064
    • Bruns, W.1    Bansal, R.2
  • 5
    • 0007101098 scopus 로고
    • Effect of stereostructure on glass transition temperatures of PMMA
    • Bywater, S. and Toporowski, P. M., "Effect of Stereostructure on Glass Transition Temperatures of PMMA," Polymer, 13, 94 (1972).
    • (1972) Polymer , vol.13 , pp. 94
    • Bywater, S.1    Toporowski, P.M.2
  • 6
    • 0035333846 scopus 로고    scopus 로고
    • Solvent effects on the collapse dynamics of polymers
    • Chang, R. and Yethiraj, A., "Solvent Effects on the Collapse Dynamics of Polymers," J. Chem. Phys., 114, 7688 (2001).
    • (2001) J. Chem. Phys. , vol.114 , pp. 7688
    • Chang, R.1    Yethiraj, A.2
  • 7
    • 24044514385 scopus 로고    scopus 로고
    • Positron Annihilation Lifetime (PAL) in PTMSP: Free volume determination and time dependence of permeability
    • Consolati, G., Genco, I., Pegoraro, M. and Zanderighi, L., "Positron Annihilation Lifetime (PAL) in PTMSP: Free Volume Determination and Time Dependence of Permeability," J Polym. Sci., Part B, Polym. Phy., 34, 357 (1996).
    • (1996) J Polym. Sci., Part B, Polym. Phy. , vol.34 , pp. 357
    • Consolati, G.1    Genco, I.2    Pegoraro, M.3    Zanderighi, L.4
  • 8
    • 0027110626 scopus 로고
    • Permporomelry: The determination of the size distribution of active pores in UF membranes
    • Cuperus, F. P., Bargeman, D. and Smolders, C. A., "Permporomelry: the Determination of the Size Distribution of Active Pores in UF Membranes," J Membr. Sci., 71, 57 (1992).
    • (1992) J Membr. Sci. , vol.71 , pp. 57
    • Cuperus, F.P.1    Bargeman, D.2    Smolders, C.A.3
  • 10
    • 0020799750 scopus 로고
    • Vibrational spectra and structure of stereoregular PMMA and of the stereocomplex
    • Dybal, J., Stokr, J. and Schneider, B., "Vibrational Spectra and Structure of Stereoregular PMMA and of the Stereocomplex," Polymer, 24, 971 (1983).
    • (1983) Polymer , vol.24 , pp. 971
    • Dybal, J.1    Stokr, J.2    Schneider, B.3
  • 12
    • 0032072365 scopus 로고    scopus 로고
    • Glass transition of stereoregular PMMA at interfaces
    • Grohens, Y., Brogly, M., Labbe, C., David, M. O. and Schulte, J., "Glass Transition of Stereoregular PMMA at Interfaces" Langmuir, 14, 2929 (1998).
    • (1998) Langmuir , vol.14 , pp. 2929
    • Grohens, Y.1    Brogly, M.2    Labbe, C.3    David, M.O.4    Schulte, J.5
  • 13
    • 0037066223 scopus 로고    scopus 로고
    • Free volume distributions in utoahigh and lower free volume polymers: Comparison between molecular modeling and positron lifetime studies
    • Hofimann, D., Heuchel, M., Yampolskii, Y., Khotimskii, V. and Shantarovich, V., "Free Volume Distributions in Utoahigh and Lower Free Volume Polymers: Comparison Between Molecular Modeling and Positron Lifetime Studies," Macmmolecules, 35, 2129 (2002).
    • (2002) Macmmolecules , vol.35 , pp. 2129
    • Hofimann, D.1    Heuchel, M.2    Yampolskii, Y.3    Khotimskii, V.4    Shantarovich, V.5
  • 15
    • 0031251036 scopus 로고    scopus 로고
    • 2D exchange NMR investigation of the α-relaxation in PEMA as compared to PMMA
    • Kuebler, S. C., Schaefer, D. J., Boeffel, C. and Spiess, H. W., "2D Exchange NMR Investigation of the α-Relaxation in PEMA as Compared to PMMA," Macromolecules, 30, 6597 (1997).
    • (1997) Macromolecules , vol.30 , pp. 6597
    • Kuebler, S.C.1    Schaefer, D.J.2    Boeffel, C.3    Spiess, H.W.4
  • 16
    • 0038107493 scopus 로고    scopus 로고
    • Molecular simulation of diffusion and sorption of gases in an amorphous polymer
    • Lim, S. Y. and Tsotsis, T. T., "Molecular Simulation of Diffusion and Sorption of Gases in an Amorphous Polymer," J. Chem. Phys., 119, 496 (2003).
    • (2003) J. Chem. Phys. , vol.119 , pp. 496
    • Lim, S.Y.1    Tsotsis, T.T.2
  • 17
    • 0347937368 scopus 로고    scopus 로고
    • Computer simulation of diffusion within and through membranes using nonequilibrium molecular dynamics
    • MacElroy, J. M. D., "Computer Simulation of Diffusion within and through Membranes using Nonequilibrium Molecular Dynamics," Korean J. Chem. Eng., 17, 129 (2000).
    • (2000) Korean J. Chem. Eng. , vol.17 , pp. 129
    • MacElroy, J.M.D.1
  • 18
    • 0343416869 scopus 로고    scopus 로고
    • Use of gas-liquid porometry measurements for selection of microfiltration membranes
    • Mietton-Peuchot, M., Condat, C. and Courtois, T., "Use of Gas-Liquid Porometry Measurements for Selection of Microfiltration Membranes," J. Membr. Sci., 133, 73 (1997).
    • (1997) J. Membr. Sci. , vol.133 , pp. 73
    • Mietton-Peuchot, M.1    Condat, C.2    Courtois, T.3
  • 19
    • 0024011164 scopus 로고
    • Effect of tacticity on permeation properties of PMMA
    • Min, K. E. and Paul, D. R., "Effect of Tacticity on Permeation Properties of PMMA," J. Polym. Sci., 26, 1021 (1988).
    • (1988) J. Polym. Sci. , vol.26 , pp. 1021
    • Min, K.E.1    Paul, D.R.2
  • 22
    • 0022150115 scopus 로고
    • Stereoregular PMMAs: Polymer-polymer and copolymer-polymer blends
    • Schroeder, J. A., Karasz, F. E. and MacKnight, W. J., "Stereoregular PMMAs: Polymer-polymer and Copolymer-polymer Blends" Polymer, 26, 1795 (1985).
    • (1985) Polymer , vol.26 , pp. 1795
    • Schroeder, J.A.1    Karasz, F.E.2    MacKnight, W.J.3
  • 23
    • 0037192211 scopus 로고    scopus 로고
    • Local dynamics of stereoregular PMMAs using molecular simulation
    • Soldera, A. and Grohens, Y., "Local Dynamics of Stereoregular PMMAs Using Molecular Simulation," Macromolecues, 35, 722 (2002).
    • (2002) Macromolecues , vol.35 , pp. 722
    • Soldera, A.1    Grohens, Y.2
  • 24
    • 0037161971 scopus 로고    scopus 로고
    • Energetic analysis of the two PMMA chain tacticities and PMA through molecular dynamics simulations
    • Soldera, A., "Energetic Analysis of the Two PMMA Chain Tacticities and PMA through Molecular Dynamics Simulations',' Polymer, 43, 4269 (2002).
    • (2002) Polymer , vol.43 , pp. 4269
    • Soldera, A.1
  • 25
    • 0033741263 scopus 로고    scopus 로고
    • Molecular modeling of polymer-chain tacticity
    • Soldera, A., "Molecular Modeling of Polymer-chain Tacticity," Polym. Plast. Technol. Eng., 39, 457 (2000).
    • (2000) Polym. Plast. Technol. Eng. , vol.39 , pp. 457
    • Soldera, A.1
  • 26
    • 0041875054 scopus 로고    scopus 로고
    • Molecular mechanics studies on polypropylene and polymethylmethacrylate polymers
    • Subramanian, V., Asirvatham, P. S., Balakrishnan, R and Ramasami, T., "Molecular Mechanics Studies on Polypropylene and Polymethylmethacrylate Polymers," Chem. Phys. Lett., 342, 603 (2001).
    • (2001) Chem. Phys. Lett. , vol.342 , pp. 603
    • Subramanian, V.1    Asirvatham, P.S.2    Balakrishnan, R.3    Ramasami, T.4
  • 27
    • 0001658015 scopus 로고
    • An Ab initio CFF93 all-atom force field for polycarbonates
    • Sun, H., Mumby, S. J., Maple, J. R. and Hagler, A. T., "An Ab Initio CFF93 All-atom Force Field for Polycarbonates," J. Am. Chem. Soc., 116, 2987 (1994).
    • (1994) J. Am. Chem. Soc. , vol.116 , pp. 2987
    • Sun, H.1    Mumby, S.J.2    Maple, J.R.3    Hagler, A.T.4
  • 28
    • 0029230553 scopus 로고
    • Ab initio calculations and force field development for computer simulation of polysilanes
    • Sun, H., "Ab Initio Calculations and Force Field Development for Computer Simulation of Polysilanes," Macromolecules, 28, 701 (1995).
    • (1995) Macromolecules , vol.28 , pp. 701
    • Sun, H.1
  • 29
    • 84986524538 scopus 로고
    • Force field for computation of conformational energies, structures, and vibrational frequencies of aromatic polyesters
    • Sun, H., "Force Field for Computation of Conformational Energies, Structures, and Vibrational Frequencies of Aromatic Polyesters," J. Comput. Chem., 15, 752 (1994).
    • (1994) J. Comput. Chem. , vol.15 , pp. 752
    • Sun, H.1
  • 30
    • 0000969936 scopus 로고
    • Conformational statistics of PMMA
    • Vacatello, M. and Flory, P. J., "Conformational Statistics of PMMA," Macromolecules, 19, 405 (1986).
    • (1986) Macromolecules , vol.19 , pp. 405
    • Vacatello, M.1    Flory, P.J.2
  • 31
    • 22944467757 scopus 로고
    • Computer experiments on classical fluids: I theimodynamical properties of lennard-jones molecules
    • Verlet, L., "Computer Experiments on Classical Fluids: I Theimodynamical Properties of Lennard-Jones Molecules," Phys. Rev., 159, 98 (1967).
    • (1967) Phys. Rev. , vol.159 , pp. 98
    • Verlet, L.1
  • 32
    • 0018319257 scopus 로고
    • Association of sereoregular PMMA: 4. Further study on the composition of the stereocomplex
    • Vorenkamp, E. J., Bosscher, F. and Challa, G., "Association of Sereoregular PMMA: 4. Further Study on the Composition of the Stereocomplex," Polymer, 20, 59 (1979).
    • (1979) Polymer , vol.20 , pp. 59
    • Vorenkamp, E.J.1    Bosscher, F.2    Challa, G.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.