Water sorption thermodynamics in glassy and rubbery polymers: Modeling the interactional issues emerging from FTIR spectroscopy

Industrial and Engineering Chemistry Research

Volumn 52, Issue 26, 2013, Pages 8674-8691

  Scherillo, Giuseppe ^a   Galizia, Michele ^a   Musto, Pellegrino ^b   Mensitieri, Giuseppe ^a  

^a UNIVERSITY OF NAPLES FEDERICO II   (Italy)

^b CNR   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

FTIR SPECTROSCOPY; LATTICE FLUID MODEL; MODEL PREDICTION; NON EQUILIBRIUM THERMODYNAMICS; QUANTITATIVE INFORMATION; SITU INFRARED SPECTROSCOPY; SPECTROSCOPY DATA; WEALTH OF INFORMATION;

FOURIER TRANSFORM INFRARED SPECTROSCOPY; GLASS; HYDROGEN BONDS; SORPTION; THERMODYNAMICS;

POLYMERS;

EID: 84879863946     PISSN: 08885885     EISSN: 15205045     Source Type: Journal    
DOI: 10.1021/ie302350w     Document Type: Article

References (84)

1. Kong, E. S.W.; Adamson, M.; Mueller, L. Moisture Diffusion and Solid-State NMR Investigations on the Physical Aging Processes in Network Epoxy Glasses Composites Technol. Res. 1984, 6, 170
2. Lawing, D.; Fornes, R. E.; Gilbert, R. D.; Memory, J. D. Temperature Dependence of Broadline NMR Spectra of Water-Soaked, Epoxy-Graphite Composites J. Appl. Phys. 1981, 52, 5906
3. Jelinski, L. W.; Dumais, J. J.; Stark, R. E.; Ellis, T. S.; Karasz, F. E. Interaction of Epoxy Resins with Water. A Quadrupole Echo Deuterium NMR Study Macromolecules 1983, 16, 1019
4. Jelinski, L. W.; Dumais, J. J.; Chiolli, A. L.; Ellis, T. S.; Karasz, F. E. Nature of the Water-Epoxy Interaction Macromolecules 1985, 18, 1091
5. Pethrick, R. A.; Hollins, E. A.; McEwan, I.; Pollock, E. A.; Hayward, D. Effect of Cure Temperature on the Structure and Water Absorption of Epoxy/Amine Thermosets Polym. Int. 1996, 39, 275
6. Hayward, D.; Hollins, E.; Johncock, P.; McEwan, I.; Pethrick, R. A.; Pollock, E. A. The Cure and Diffusion of Water in Halogen Containing Epoxy/Amine Thermosets Polymer 1997, 38, 1151
7. Grave, C.; McEwan, I.; Pethrick, R. A. Influence of Stoichiometric Ratio on Water Absorption in Epoxy Resins J. Appl. Polym. Sci. 1998, 69, 2369
8. 2O Molecules J. Phys. Chem. B 1999, 103, 4979
9. Ngono, Y.; Maréchal, Y. Epoxy-Amine Reticulates Observed by Infrared Spectrometry. II. Modifications of Structure and of Hydration Abilities after Irradiation in a Dry Atmosphere J. Polm. Sci., Part B 2000, 38, 329
10. Zhou, J.; Lucas, J. P. Hygrothermal Effects of Epoxy Resin. Part I: The Nature of Water in Epoxy Polymer 1999, 40, 5505
11. Musto, P.; Ragosta, G.; Mascia, L. Vibrational Spectroscopy Evidence for the Dual Nature of Water Sorbed into Epoxy Resins Chem. Mater. 2000, 12, 1331
12. Van Alsten, J. G. Diffusion Measurements in Polymers Using IR Attenuated Total Reflectance Spectroscopy Trends Polym. Sci. 1995, 3 (8) 272
13. Fieldson, G. T.; Barbari, A. T. The Use of FTIR-ATR Spectroscopy to Characterize Penetrant Diffusion in Polymers Polymer 1993, 34 (6) 1146
14. Fieldson, G. T.; Barbari, A. T. Analysis of Diffusion in Polymers Using Evanescent Field Spectroscopy AIChE J. 1995, 41 (4) 795
15. Barbari, A. T.; Kasargod, S. S.; Fieldson, G. T. Effect of Unequal Transport Rates and Intersolute Solvation on the Selective Batch Extraction of a Dilute Mixture with a Dense Polymeric Sorbent Ind. Eng. Chem. Res. 1996, 35, 1188
16. Hong, S. U.; Barbari, A. T.; Sloan, J. M. Multicomponent Diffusion of Methyl Ethyl Ketone and Toluene in Polyisobutylene from Vapor Sorption FTIR-ATR Spectroscopy J. Polm: Sci: Part B 1998, 36, 337
17. Cotugno, S.; Larobina, D.; Mensitieri, G.; Musto, P.; Ragosta, G. A Novel Spectroscopic Approach to Investigate Transport Processes in Polymers: The Case of Water/Epoxy System Polymer 2001, 42, 6431
18. Musto, P.; Mascia, L.; Ragosta, G.; Scarinzi, G.; Villano, P. The Transport of Water in a Tetrafunctional Epoxy Resin by Near-Infrared Fourier Transform Spectroscopy Polymer 2000, 41, 565
19. Wu, P.; Siesler, H. W. The Diffusion of Alcohols and Water in Polyamide 11: A Study by Fourier-Transform near-Infrared Spectroscopy Macromol. Symp. 1999, 143, 323
20. 2O System Macromolecules 2005, 38, 801
21. Mascia, L.; Mensitieri, G.; Musto, P.; Ragosta, G. Diffusion of Water and Ammonia through Polyimide-Silica Bicontinuous Nanocomposites: Interactions and Reactions Polymer 2005, 46, 4492
22. Mensitieri, G.; Lavorgna, M.; Musto, P.; Ragosta, G. Water Transport in Densely Crosslinked Networks: A Comparison between Epoxy Systems Having Different Interactive Character Polymer 2006, 47, 8326
23. Larobina, D.; Lavorgna, M.; Mensitieri, G.; Musto, P.; Vautrin, A. Water Diffusion in Glassy Polymers and Their Silica Hybrids: An Analysis of State of Water Molecules and of the Effect of Tensile Stress Macromol. Symp. 2007, 247, 11
24. 2O Diffusion into Polyimides. A Vibrational Spectroscopy Investigation Macromolecules 2007, 40 (26) 9614
25. 2O Diffusion into Polyimides: A Model Based on Dual Mobility with Instantaneous Local Non-linear Equilibrium Macromolecules 2008, 41, 4850
26. Scherillo, G.; Sanguigno, L.; Sansone, L.; Di Maio, E.; Galizia, M.; Mensitieri, G. Thermodynamics of Water Sorption in Poly(ε-caprolactone): A Comparative Analysis of Lattice Fluid Models Including Hydrogen Bond Contributions Fluid Phase Equilib. 2012, 313, 127
27. Musto, P.; Mensitieri, G.; Lavorgna, M.; Scarinzi, G.; Scherillo, G. Combining Gravimetric and Vibrational Spectroscopy Measurements to Quantify First- and Second-Shell Hydration Layers in Polyimides with Different Molecular Architectures J. Phys. Chem. B 2012, 116, 1209
28. Scherillo, G.; Sanguigno, L.; Galizia, M.; Lavorgna, M.; Musto, P.; Mensitieri, G. Non-equilibrium Compressible Lattice Theories Accounting for Hydrogen Bonding Interactions: Modelling Water Sorption Thermodynamics in Fluorinated Polyimides Fluid Phase Equilib. 2012, 334, 166
29. De Angelis, M. G.; Doghieri, F.; Sarti, G. C.; Freeman, B. D. Modeling Gas Sorption in Amorphous Teflon Throughthe Non Equilibrium Thermodynamics for Glassy Polymers (NETGP) Approach Desalination 2006, 193, 82
30. Pantoula, M.; von Schnitzler, J.; Eggers, R.; Panayiotou, C. Sorption and Swelling in Glassy Polymer/Carbon Dioxide Systems Part II-Swelling J. Supercrit. Fluids 2007, 39, 426
31. Panayiotou, C.; Sanchez, I. C. Hydrogen Bonding in Fluids-An Equation-of-State Approach J. Phys. Chem. 1991, 95, 10090
32. Sanchez, I. C.; Lacombe, R. H. An Elementary Molecular Theory of Classical Fluids. Pure Fluids J. Phys. Chem. 1976, 80, 2352
33. Sanchez, I. C.; Lacombe, R. H. Statistical Thermodynamics of Fluid Mixtures J. Phys. Chem. 1976, 80, 2568
34. Sanchez, I. C.; Lacombe, R. H. Statistical Thermodynamics of Polymer Solutions Macromolecules 1978, 11, 1145
35. Veytsman, B. A. Are Lattice Models Valid for Fluids with Hydrogen Bonds? J. Phys. Chem. 1990, 94, 8499
36. Veytsman, B. A. Equation of State for Hydrogen-Bonded Systems J. Phys. Chem. 1998, B 102, 7515
37. Prausnitz, J. M.; Lichtenthaler, R. N.; Gomes de Azevedo, E. Molecular Thermodynamics of Fluid-Phase Equilibria, 3 rd ed.; Prentice Hall PTR: Upper Saddle River, NJ, 1998.
38. Guggenheim, E. A. Mixtures; Oxford University Press: Oxford, 1952.
39. Panayiotou, C.; Vera, J. H. Statistical Thermodynamics of r-Mer Fluids and Their Mixtures Polymer J. 1982, 14, 681
40. You, S. S.; Yoo, K. P.; Lee, C. S. An Approximate Nonrandom Lattice Theory of Fluids: General Derivation and Application to Pure Fluids Fluid Phase Equilib. 1994, 93, 193
41. Taimoori, M.; Panayiotou, C. The Nonrandom Distribution of Free Volume in Fluids: Nonpolar Systems Fluid Phase Equilib. 2001, 192, 155
42. Yeom, M. S.; Yoo, K. P.; Park, B. H.; Lee, C. S. A Nonrandom Lattice Fluid Hydrogen Bonding Theory for Phase Equilibria of Associating Systems Fluid Phase Equilib. 1999, 158, 143
43. Panayiotou, C.; Pantoula, M.; Stefanis, E.; Tsivintzelis, I.; Economou, I. G. Nonrandom Hydrogen-Bonding Model of Fluids and Their Mixtures. 1. Pure Fluids Ind. Eng. Chem. Res. 2004, 43, 6592
44. Vlachou, T.; Prinos, I.; Vera, J. H.; Panayiotou, C. Nonrandom Distribution of Free Volume in Fluids and their Mixtures: Hydrogen-Bonded Systems Ind. Eng. Chem. Res. 2002, 41, 1057
45. Panayiotou, C. The QCHB Model of Fluids and their Mixtures J. Chem. Thermodyn. 2003, 35, 349
46. Panayiotou, C.; Tsivintzelis, I.; Economou, I. G. Nonrandom Hydrogen-Bonding Model of Fluids and their Mixtures. 2. Multicomponent Mixtures Ind. Eng. Chem. Res. 2007, 46, 2628
47. Panayiotou, C. G.; Birdi, K. S. Handbook of Surface and Colloid Chemistry, 2 nd ed.; CRC Press LLC Taylor and Francis Group: New York, 2003.
48. Panayiotou, C. G.; Birdi, K. S. Handbook of Surface and Colloid Chemistry, 3 rd ed.; CRC Press Taylor and Francis Group: New York, 2009.
49. Tsivintzelis, I.; Kontogeorgis, G. M. Modeling the Vapor-Liquid Equilibria of Polymer-Solvent Mixtures: Systems with Complex Hydrogen Bonding Behavior Fluid Phase Equilib. 2009, 280, 100
50. Barrer, R. M.; Barrie, J. A.; Slater, J. Sorption and Diffusion in Ethyl Cellulose. Part III. Comparison between Ethyl Cellulose and Rubber J. Polym. Sci. 1958, 27, 177
51. Michaels, A. S.; Vieth, W. R.; Barrie, J. A. Solution of Gases in Polyethylene Terephthalate J. Appl. Phys. 1963, 34, 1
52. Flory, P. J. Principles of Polymer Chemistry; Cornell University Press: Ithaca, NY, 1953.
53. Mensitieri, G.; Del Nobile, M. A.; Apicella, A.; Nicolais, L. Moisture-Matrix Interactions in Polymer Based Composite Materials Rev. Inst. Français Pét. 1995, 50, 551
54. Donder, T. Affinity; Standford University Press: Menlo Park, CA, 1936.
55. Staverman, A. J. Thermodynamic Aspects of the Glass-Rubber Transition Rheol. Acta 1966, 5, 283
56. Gibbs, J. H.; Di Marzio, E. A. Nature of the Glass Transition and the Glassy State J. Chem. Phys. 1958, 28, 373
57. Astarita, G.; Paulaitis, M. E.; Wissinger, R. G. Thermodynamics of the Glass Transition J. Polym. Sci., Polym. Phys. 1989, 27, 2105
58. Wissinger, R. G.; Paulaitis, M. E. Molecular Thermodynamic Model for Sorption and Swelling in Glassy Polymer-Carbon Dioxide Systems at Elevated Pressures Ind. Eng. Chem. Res. 1991, 30, 842
59. Doghieri, F.; Sarti, G. C. Nonequilibrium Lattice Fluids: A Predictive Model for the Solubility in Glassy Polymers Macromolecules 1996, 29, 7885
60. Conforti, R. M.; Barbari, T. A.; Vimalchand, P.; Donohue, M. D. A Lattice-based Activity Coefficient Model for Gas Sorption in Glassy Polymers Macromolecules 1991, 24, 3388
61. Conforti, V; Barbari, T. A. A Thermodynamic Analysis of Gas Sorption-Desorption Hysteresis in Glassy Polymers Macromolecules 1993, 26, 5209
62. Doghieri, F.; Quinzi, M.; Rethwisch, D. G.; Sarti, G. C. In Advanced Materials for Membrane Separations; Pinnau, I.; Freeman, B.D., Eds.; ACS Symposium Series No. 876; American Chemical Society: Washington, DC, 2004; pp 74-90.
63. Tortora, M.; Vittoria, V.; Galli, G.; Ritrovati, S.; Chiellini, E. Transport Properties of Modified Montmorillonite-Poly(ε -caprolactone) Nanocomposites Macromol. Mater. Eng. 2002, 287, 243
64. Gorrasi, G.; Tortora, M.; Vittoria, V.; Pollet, E.; Lepoittevin, B.; Alexandre, M.; Dubois, P. Vapor Barrier Properties of Polycaprolactone Montmorillonite Nanocomposites: Effect of Clay Dispersion Polymer 2003, 44, 2271
65. Goff, D. L.; Yuan, E. L.; Long, H.; Neuhaus, H. J. In Polymer Materials for Electronics, Packaging and Interconnection; American Chemical Society; Washington D.C., 1989.
66. Coleman, M. R.; Koros, W. J. Isomeric Polyimides Based on Fluorinated Dianhydrides and Diamines for Gas Separation Spplications J. Membr. Sci. 1990, 50, 285
67. Matsuura, T.; Hasuda, Y.; Nishi, S.; Noriyoshi, Y. Polyimide Derived from 2,2′Bis(trifluoromethyl)-4,4′-diaminobiphenyl. 1. Synthesis and Characterization of Polyimides Prepared with 2,2′-bis(3,4-dicarboxyphenyl) Hexafluoropropane Dianhydride or Pyromellitic Dianhydride Macromolecules 1991, 24, 5001
68. Ragosta, G.; Musto, P.; Abbate, M.; Scarinzi, G. Compatibilizing Polyimide/Silica Hybrids by Alkoxisilane-Terminated Oligoimides: Morphology-Properties Relationships J. Appl. Polym. Sci. 2011, 121, 2168
69. Marquardt, D. W. An Algorithm for Least-Squares Estimation of Nonlinear Parameters J. Soc. Ind. Appl. Math. 1963, 11, 431
70. Meier, R. J. On Art and Science in Curve-Fitting Vibrational Spectra Vib. Spectrosc. 2005, 39, 266
71. Noda, I.; Ozaki, Y. Two Dimensional Correlation Spectroscopy; Wiley: Chichester, UK, 2004.
72. 2 Ind. Eng. Chem. Res. 2006, 45, 1183
73. Sarti, G. C.; Doghieri, F. Predictions of the Solubility of Gases in Glassy Polymers Based on the NELF Model Chem. Eng. Sci. 1998, 19, 3435
74. Boudouris, D.; Panayiotou, C. On the Solubility of Gas Molecules in Glassy Polymers and the Nonequilibrium Approach Macromolecules 1998, 31, 7915
75. Astarita, G. Thermodynamics. An Advanced Textbook for Chemical Engineers; Plenum Press: New York, 1989.
76. Giacinti Baschetti, M.; Doghieri, F.; Sarti, G. C. Solubility in Glassy Polymers: Correlations through the Nonequilibrium Lattice Fluid Model Ind. Eng. Chem. Res. 2001, 40, 3027
77. Musto, P.; Ragosta, G.; Mensitieri, G. Time-resolved FTIR Spectroscopy: A Powerful Tool to Investigate Diffusion Processes in Polymeric Films and Membranes. e-Polymers 2002, article number 017.
78. Marechal, Y. J. Observing the Water Molecule in Macromolecules and Aqueous Media Using Infrared Spectrometry J. Mol. Struct. 2003, 648, 27
79. 3 Homopolymers J. Mol. Struct. 2004, 693, 35
80. 2O Molecules in a Protein (Stratum Corneum) by Infrared Spectrometry J. Mol. Struct. 1997, 416, 133
81. Noda, I.; Dowrey, A. E.; Marcott, C.; Story, G. M.; Ozaki, Y. Generalized Two-Dimensional Correlation Spectroscopy Appl. Spectrosc. 2000, 54, 236A
82. Ishida, H.; Wellinghoff, S. T.; Baer, E.; Koenig, J. L. Spectroscopic Studies of Poly[ N, N ′-bis(phenoxyphenyl)pyromellitimide]. 1. Structures of the Polyimide and Three Model Compounds Macromolecules 1980, 13, 826
83. Saini, A. K.; Carlin, C. M.; Patterson, H. H. Spectroscopic Studies of New Model Compounds for Poly[ N,N′ -bis(phenoxyphenyl)pyromellitimide] J. Polym. Sci., A 1992, 30, 419
84. 13C CP-MAS NMR Study of Absorbed Water in Polyimide Film J. Appl. Polym. Sci. 1994, 53, 59