Molecular dynamics studies of the phase transitions of homopolymers of p-hydroxybenzoic acid

Journal of Physical Chemistry B

Volumn 103, Issue 34, 1999, Pages 7111-7121

  Nolan, M ^a   Greer, J C ^a  

^a UNIVERSITY COLLEGE CORK   (Ireland)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 20544473824     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp990101n     Document Type: Article

References (28)

1. Economy, J.; Storm, R. S.; Matkovich, V. I.; Cottis, S. G.; Nowak, B. E. J. Polym. Sci., Polym. Chem. Ed. 1976, 14, 2207.
2. Lieser, G. J. Polym. Sci., Polym. Phys. Ed. 1983, 21, 1161.
3. Hanna, S.; Windle, A. Polym. Commun. 1988, 29, 236.
4. Economy, J.; Volksen, W.; Viney, C.; Geiss, R.; Siemens, R.; Karis, T. Macromolecules 1988, 21, 2777.
5. Kricheldorf, H. R.; Schwarz, G. Polymer 1990, 31, 481.
6. Yoon, D. Y.; Masciccochi, N.; Depero, L. E.; Viney, C.; Parrish, W. Macromolecules 1990, 23, 1793.
7. Iannelli, P.; Yoon, D. Y. J. Polym. Sci., Part B: Polym. Phys. 1995, 33, 977.
8. Coulter, P. D.; Hanna, S.; Windle, A. Liq. Cryst. 1989, 5, 1603.
9. (a) Sun, H.; Mumby, S. J.; Maple, J. R.; Hagler, A. T. J. Am Chem. Soc. 1994, 116, 2978.
10. (b) Sun, H. J. Comput. Chem. 1994, 15, 752.
11. (c) Sun, H. Macromolecules 1995, 28, 701.
12. Allen, M. P.; Tildesley, D. Computer Simulation of Liquids; Clarendon Press: Oxford Science Publications, New York, 1989.
13. van Gunsteren, W. F.; Mark A. E. J. Chem. Phys. 1998, 108, 6109.
14. Flores, A.; Ania, F.; Balta Calleja, F. J.; Ward, I. M. Polymer 1993, 34, 2915.
15. Jackson, J. W., Jr. Br. Polym. J. 1980, 12, 154.
16. Huth, J.; Mosell, T.; Nicklas, K.; Sariban, A.; Brickmann, J. J. Phys. Chem. 1994, 95, 7685.
17. Fougler, S.; Rutledge, G. C. Macromolecules 1995, 28, 7075.
18. Rutledge, G. C. Private communication.
19. Becke, A. D. Phys. Rev. 1988, 38A, 3098.
20. Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. 1988, 37B, 785.
21. Harihan, P. C.; Pople, J. A. Theor. Chim. Acta 1973, 28, 213.
22. Treutler, O.; Ahlrichs, R. J. Chem. Phys. 1995, 102, 346.
23. Ahlrichs, R.; Baer, M.; Haeser, M.; Horn, H.; Koelmel, C. Chem. Phys. Lett. 1989, 162, 165.
24. 2 molecular modeling system.
25. Parrinello, M.; Rahman, A. J. Appl. Phys. 1981, 52, 7182.
26. Nosé, S. J. Chem. Phys. 1984, 81, 511.
27. Hoover, W. G. Phys. Rev. 1985, A31, 1695.
28. Verlet, L. Phys. Rev. 1967, 159, 98.