Effect of nanoconfinement on kinetics of cross-linking reactions: A molecular simulation study

Journal of Physical Chemistry B

Volumn 115, Issue 43, 2011, Pages 12348-12355

  Lin, Po Han ^a   Kohale, Swapnil C ^a   Khare, Rajesh ^a  

^a Department of Electrical and Computer Engineering   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; CURING; KINETICS; MOLECULAR DYNAMICS;

AUTOCATALYTIC; BEAD-SPRING MODELS; BULK VALUE; CENTRAL CORE; CONFINED SYSTEMS; CROSSLINKING REACTION; CURING REACTIONS; CYLINDRICAL PORES; EPOXY CURING; INITIAL POSITION; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR SIMULATIONS; NANOCONFINEMENTS; PORE WALL; SPATIAL PROXIMITY;

REACTION RATES;

EID: 80055021262     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp2038398     Document Type: Article

References (32)

1. Jackson, C. L.; McKenna, G. B. J. Chem. Phys. 1990, 93, 9002-9011
2. Jackson, C. L.; McKenna, G. B. J. Non-Cryst. Solids 1991, 131, 221-224
3. Huck, W. T. S. Chem. Commun. 2005, 4143-4148
4. Alcoutlabi, M.; McKenna, G. B. J. Phys.: Condens. Matter 2005, 17, R461-R524
5. Alba-Simionesco, C.; Coasne, B.; Dosseh, G.; Dudziak, G.; Gubbins, K. E.; Radhakrishnan, R.; Sliwinska-Bartkowiak, M. J. Phys.: Condens. Matter 2006, 18, R15-R68
6. Varnik, F.; Binder, K. Int. J. Mater. Res. 2009, 100, 1494-1502
7. Barrat, J. L.; Baschnagel, J.; Lyulin, A. Soft Matter 2010, 6, 3430-3446
8. Li, Q. X.; Simon, S. L. Macromolecules 2008, 41, 1310-1317
9. Li, Q. X.; Simon, S. L. Macromolecules 2009, 42, 3573-3579
10. Koh, Y. P.; Li, Q. X.; Simon, S. L. Thermochim. Acta 2009, 492, 45-50
11. Koh, Y. P.; Simon, S. L. J. Phys. Chem. B 2010, 114, 7727-7734
12. Begum, F.; Simon, S. L. Polymer 2011, 52, 1539-1545
13. Scheidler, P.; Kob, W.; Binder, K. Europhys. Lett. 2002, 59, 701-707
14. Scheidler, P.; Kob, W.; Binder, K. Eur. Phys. J. E 2003, 12, 5-9
15. Malvaldi, M.; Bruzzone, S.; Raos, G.; Allegra, G. J. Phys. Chem. B 2007, 111, 4141-4149
16. Vogel, M. Macromolecules 2009, 42, 9498-9505
17. Malvaldi, M.; Bruzzone, S.; Picchioni, F. J. Phys. Chem. B 2006, 110, 12281-12288
18. Weeks, J. D.; Chandler, D.; Andersen, H. C. J. Chem. Phys. 1971, 54, 5237-5247
19. Khare, R.; de Pablo, J.; Yethiraj, A. J. Chem. Phys. 1997, 107, 2589-2596
20. Pang, K. P.; Gillham, J. K. J. Appl. Polym. Sci. 1989, 37, 1969-1991
21. Wisanrakkit, G.; Gillham, J. K. J. Appl. Polym. Sci. 1990, 41, 2885-2929
22. Allen, M. P.; Tildesley, D. J. Computer simulation of liquids; Oxford University Press: New York, 1989.
23. Simon, S. L.; Gillham, J. K. J. Appl. Polym. Sci. 1992, 46, 1245-1270
24. Tanaka, Y.; Bauer, R. S. Curing Reactions. In Epoxy Resins: Chemistry and Technology; May, C. A., Ed.; Marcel Dekker, Inc.: New York: 1988; p 298.
25. Xu, J.; Viasnoff, V.; Wirtz, D. Rheol. Acta 1998, 37, 387-398
26. McKinley, S. A.; Yao, L.; Forest, M. G. J. Rheol. 2009, 53, 1487-1506
27. Saxton, M. J. Biophys. J. 1994, 66, 394-401
28. Condamin, S.; Tejedor, V.; Voituriez, R.; Benichou, O.; Klafter, J. Proc. Natl. Acad. Sci. U.S.A. 2008, 105, 5675-5680
29. Szymanski, J.; Weiss, M. Phys. Rev. Lett. 2009, 103, 038102
30. Skaug, M. J.; Faller, R.; Longo, M. L. J. Chem. Phys. 2011, 134, 215101
31. Kusmin, A.; Gruener, S.; Henschel, A.; de Souza, N.; Allgaier, J.; Richter, D.; Huber, P. Macromolecules 2010, 43, 8162-8169
32. Kusmin, A.; Gruener, S.; Henschel, A.; Holderer, O.; Allgaier, J.; Richter, D.; Huber, P. J. Phys. Chem. Lett. 2010, 1, 3116-3121