Coarse grained model of entangled polymer melts

Journal of Chemical Physics

Volumn 125, Issue 16, 2006, Pages

  Rakshit, A ^a   Picu, R C ^a  

^a RENSSELAER POLYTECHNIC INSTITUTE   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALIBRATION; CONFORMAL MAPPING; LINEAR SYSTEMS; MATHEMATICAL MODELS; MOLTEN MATERIALS; PROBABILITY; RELAXATION PROCESSES;

CHAIN STRUCTURE; COARSE GRAINED MODEL; ENTANGLED POLYMER MELTS; ENTANGLEMENT SEGMENT;

ORGANIC POLYMERS;

EID: 33750456961     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2362820     Document Type: Article

References (39)

1. H. Grabert, Projection Operator Techniques in Non-Equilibrium Statistical Mechanics (Springer, Berlin, 1982).
2. A. Acharya, Comput. Methods Appl. Mech. Eng. 194, 3067 (2005).
3. K. Kremer and G. S. Grest, J. Chem. Phys. 92, 5057 (1990).
4. Y. Wang, R. Rajagopalan, and W. L. Mattice, Phys. Rev. Lett. 74, 2503 (1995).
5. C. Mischler, J. Baschnagel, and K. Binder, Adv. Colloid Interface Sci. 94, 197 (2001).
6. F. Eurich and P. Maass, J. Chem. Phys. 114, 7655 (2001).
7. W. Tschop, K. Kremer, J. Batoulis, T. Burger, and O. Hahn, Acta Polym. 49, 61 (1998).
8. D. Reith, H. Meyer, and F. Muller-Plathe, Macromolecules 34, 2335 (2001).
9. F. Muller-Plathe, Chem. Phys. 3, 754 (2002).
10. W. Paul, D. Y. Yoon, and G. D. Smith, J. Chem. Phys. 103, 1702 (1995).
11. P. K. Depa and J. K. Maranas, J. Chem. Phys. 123, 094901 (2005).
12. R. L. C. Akkermans and W. J. Briels, J. Chem. Phys. 113, 6409 (2000).
13. R. L. C. Akkermans and W. J. Briels, J. Chem. Phys. 114, 1020 (2001).
14. J. T. Padding and W. J. Briels, J. Chem. Phys. 115, 2846 (2001).
15. C. C. Hua and J. D. Schieber, J. Chem. Phys. 109, 10018 (1998).
16. Y. Masubuchi, J.-I. Takimoto, K. Koyama, G. Ianniruberto, G. Marrucci, and F. Greco, J. Chem. Phys. 115, 4387 (2001).
17. R. C. Picu and M. C. Pavel, Macromolecules 36, 9205 (2003).
18. H. Berendsen, J. Postma, and W. F. van Gunsteren, J. Chem. Phys. 81, 3684 (1984).
19. J. Gao and J. H. Weiner, Science 266, 748 (1994).
20. R. C. Picu and J. H. Weiner, J. Chem. Phys. 108, 4984 (1998).
21. W. G. Hoover, Computational Statistical Mechanics (Elsevier, Amsterdam, 1991).
22. M. Putz, K. Kremer, and G. S. Grest, Europhys. Lett. 49, 735 (2000).
23. M. Kröger and S. Hess, Phys. Rev. Lett. 85, 1128 (2000).
24. D. Reith, M. Putz, and F. Muller-Plathe, J. Comput. Chem. 24, 1624 (2003).
25. R. Zwanzig, J. Chem. Phys. 33, 1338 (1960).
26. H. Mori, Prog. Theor. Phys. 33, 423 (1965).
27. P. Mazur and I. Oppenheim, Physica (Amsterdam) 50, 241 (1970).
28. P. Espanol and I. Zuniga, J. Chem. Phys. 98, 574 (1993).
29. F. Ould-Kaddour and D. Levesque, J. Chem. Phys. 118, 7888 (2003).
30. G. S. Ayton, H. L. Tepper, D. T. Mirijanian, and G. A. Voth, J. Chem. Phys. 120, 4074 (2004).
31. T. A. Kavassalis and J. Noolandi, Macromolecules 21, 2869 (1988).
32. M. Doi and S. F. Edwards, The Theory of Polymer Dynamics (Clarendon, Oxford, 1986).
33. R. S. Graham, A. E. Likhtman, T. C. B. McLeish, and S. T. Milner, J. Rheol. 47, 1171 (2003).
34. W. F. van Gunsteren and H. J. C. Berendsen, Mol. Phys. 45, 637 (1982).
35. W. Paul, G. D. Smith, D. Y. Yoon, D. Fargo, S. Rathgeber, A. Zirkel, L. Willner, and D. Richter, Phys. Rev. Lett. 80, 2346 (1998).
36. J. T. Padding and W. J. Briels, J. Chem. Phys. 117, 925 (2002).
37. B. Dunweg, G. S. Grest, and K. Kremer, Numerical Methods for Polymeric Systems, The IMA Volumes in Mathematics and its Applications Vol. 102 (Springer, New York, 1998), p. 159.
38. S. T. Milner and T. C. B. McLeish, Phys. Rev. Lett. 81, 725 (1998).
39. A. L. Frischknecht and S. T. Milner, Macromolecules 33, 5273 (2000).