Patchy particle model for vitrimers

Physical Review Letters

Volumn 111, Issue 18, 2013, Pages

  Smallenburg, Frank ^a   Leibler, Ludwik ^b   Sciortino, Francesco ^a  

^a SAPIENZA UNIVERSITY OF ROME   (Italy)

^b PSL RESEARCH UNIVERSITY   (France)

Author keywords

[No Author keywords available]

Indexed keywords

COVALENT NETWORK; EXCHANGE MECHANISM; GLASS FORMING ABILITY; NETWORK LINKS; PATCHY PARTICLES; SWELLING BEHAVIOR; THERMODYNAMIC PERTURBATION THEORY; WERTHEIM;

PHASE SEPARATION;

COMPUTER SIMULATION;

EID: 84887050287     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.111.188002     Document Type: Article

References (38)

1. D. Montarnal, M. Capelot, F. Tournilhac, and L. Leibler, Science 334, 965 (2011). SCIEAS 0036-8075 10.1126/science.1212648
2. M. Capelot, D. Montarnal, F. Tournilhac, and L. Leibler, J. Am. Chem. Soc. 134, 7664 (2012). JACSAT 0002-7863 10.1021/ja302894k
3. M. Capelot, M. M. Unterlass, F. Tournilhac, and L. Leibler, ACS Macro Lett. 1, 789 (2012). AMLCCD 2161-1653 10.1021/mz300239f
4. Y.-X. Lu, F. Tournilhac, L. Leibler, and Z. Guan, J. Am. Chem. Soc. 134, 8424 (2012). JACSAT 0002-7863 10.1021/ja303356z
5. P. Zheng and T. J. McCarthy, J. Am. Chem. Soc. 134, 2024 (2012). JACSAT 0002-7863 10.1021/ja2113257
6. C. J. Kloxin and C. N. Bowman, Chem. Soc. Rev. 42, 7161 (2013). CSRVBR 0306-0012 10.1039/c3cs60046g
7. R. Long, H. J. Qi, and M. L. Dunn, Soft Matter 9, 4083 (2013). SMOABF 1744-683X 10.1039/c3sm27945f
8. J. Kolafa and I. Nezbeda, Mol. Phys. 61, 161 (1987). MOPHAM 0026-8976 10.1080/00268978700101051
9. F. Romano, P. Tartaglia, and F. Sciortino, J. Phys. Condens. Matter 19, 322101 (2007). JCOMEL 0953-8984 10.1088/0953-8984/19/32/322101 (Pubitemid 47154883)
10. H. Liu, S. K. Kumar, and F. Sciortino, J. Chem. Phys. 127, 084902 (2007). JCPSA6 0021-9606 10.1063/1.2768056 (Pubitemid 47352556)
11. C. Gögelein, G. Nägele, R. Tuinier, T. Gibaud, A. Stradner, and P. Schurtenberger, J. Chem. Phys. 129, 085102 (2008). JCPSA6 0021-9606 10.1063/1.2951987
12. J. P. Doye, A. A. Louis, I.-C. Lin, L. R. Allen, E. G. Noya, A. W. Wilber, H. C. Kok, and R. Lyus, Phys. Chem. Chem. Phys. 9, 2197 (2007). PPCPFQ 1463-9076 10.1039/b614955c
13. N. Dorsaz, L. Filion, F. Smallenburg, and D. Frenkel, Faraday Discuss. 159, 9 (2012). FDISE6 1359-6640 10.1039/c2fd20070h
14. E. Bianchi, J. Largo, P. Tartaglia, E. Zaccarelli, and F. Sciortino, Phys. Rev. Lett. 97, 168301 (2006). PRLTAO 0031-9007 10.1103/PhysRevLett.97. 168301 (Pubitemid 44583235)
15. E. Bianchi, R. Blaak, and C. N. Likos, Phys. Chem. Chem. Phys. 13, 6397 (2011). PPCPFQ 1463-9076 10.1039/c0cp02296a
16. D. de las Heras, J. M. Tavares, and M. M. Telo da Gama, Soft Matter 8, 1785 (2012). SMOABF 1744-683X 10.1039/c1sm06948a
17. F. Sciortino, Eur. Phys. J. B 64, 505 (2008). EPJBFY 1434-6028 10.1140/epjb/e2008-00034-0
18. F. J. Martinez-Veracoechea, B. M. Mladek, A. V. Tkachenko, and D. Frenkel, Phys. Rev. Lett. 107, 045902 (2011). PRLTAO 0031-9007 10.1103/PhysRevLett.107.045902
19. F. Romano and F. Sciortino, Nat. Commun. 3, 975 (2012). NCAOBW 2041-1723 10.1038/ncomms1968
20. Y. Wang, Y. Wang, D. R. Breed, V. N. Manoharan, L. Feng, A. D. Hollingsworth, M. Weck, and D. J. Pine, Nature (London) 491, 51 (2012). NATUAS 0028-0836 10.1038/nature11564
21. B. Ruzicka, E. Zaccarelli, L. Zulian, R. Angelini, M. Sztucki, A. Moussad, T. Narayanan, and F. Sciortino, Nat. Mater. 10, 56 (2011). NMAACR 1476-1122 10.1038/nmat2921
22. S. Biffi, R. Cerbino, F. Bomboi, E. Maria Paraboschi, R. Asselta, F. Sciortino, and T. Bellini Proc. Natl. Acad. Sci. U.S.A. 110, 15633 (2013). PNASA6 0027-8424 10.1073/pnas.1304632110
23. X. Mao, Q. Chen, and S. Granick, Nat. Mater. 12, 217 (2013). NMAACR 1476-1122 10.1038/nmat3496
24. Q. Chen, S. C. Bae, and S. Granick, Nature (London) 469, 381 (2011). NATUAS 0028-0836 10.1038/nature09713
25. S. Jiang, Q. Chen, M. Tripathy, E. Luijten, K. S. Schweizer, and S. Granick, Adv. Mater. 22, 1060 (2010). ADVMEW 0935-9648 10.1002/adma.200904094
26. A. B. Pawar and I. Kretzschmar, Macromol. Rapid Commun. 31, 150 (2010). MRCOE3 1022-1336 10.1002/marc.200900614
27. F. Smallenburg and F. Sciortino, Nat. Phys. 9, 554 (2013). NPAHAX 1745-2473 10.1038/nphys2693
28. M. S. Wertheim, J. Stat. Phys. 35, 19 (1984). JSTPBS 0022-4715 10.1007/BF01017362
29. M. S. Wertheim, J. Stat. Phys. 35, 35 (1984). JSTPBS 0022-4715 10.1007/BF01017363
30. N. Kern and D. Frenkel, J. Chem. Phys. 118, 9882 (2003). JCPSA6 0021-9606 10.1063/1.1569473
31. See Supplemental Material at http://link.aps.org/supplemental/10.1103/ PhysRevLett.111.188002 for additional details on the derivation of the free energy, phase diagrams for different parameter choices, details on the viscosity measurements, an explanation of the entropy change associated with cluster coalescence, and a movie of a simulation of two merging clusters.
32. D. de las Heras, J. M. Tavares, and M. M. Telo da Gama, Soft Matter 7, 5615 (2011). SMOABF 1744-683X 10.1039/c0sm01493a
33. D. Frenkel and B. Smit, Understanding Molecular Simulations: From Algorithms to Applications (Academic Press, San Diego, CA, 2002).
34. C. A. Angell, Science 267, 1924 (1995). SCIEAS 0036-8075 10.1126/science.267.5206.1924
35. P. G. Debenedetti, Metastable Liquids: Concepts and Principles (Princeton University Press, Princeton, NJ, 1996).
36. B. J. Alder, D. M. Gass, and T. E. Wainwright, J. Chem. Phys. 53, 3813 (1970). JCPSA6 0021-9606 10.1063/1.1673845
37. A. M. Puertas, C. De Michele, F. Sciortino, P. Tartaglia, and E. Zaccarelli, J. Chem. Phys. 127, 144906 (2007). JCPSA6 0021-9606 10.1063/1.2772628 (Pubitemid 47569047)
38. P. J. Flory, J. Am. Chem. Soc. 63, 3083 (1941). JACSAT 0002-7863 10.1021/ja01856a061