Molecular dynamics simulation of CH 4 hydrate decomposition in the presence of poly(2-ethyl-2-oxazoline)

Wuli Huaxue Xuebao/ Acta Physico - Chimica Sinica

Volumn 28, Issue 7, 2012, Pages 1683-1690

  Wang, Yan Hong ^a   Chen, Yu Juan ^a   Bao, Ling ^a   Lang, Xue Mei ^a   Fan, Shuan Shi ^a  

^a SOUTH CHINA UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

CH 4 hydrate; Hydrate inhibitor; Molecular dynamics simulation; Poly(2 ethyl 2 oxazoline)

Indexed keywords

EID: 84862257709     PISSN: 10006818     EISSN: None     Source Type: Journal    
DOI: 10.3866/PKU.WHXB201204113     Document Type: Article

References (28)

1. Sum, A. K.; Koh, C. A.; Sloan, E. D. Industrial & Engineering Chemistry Research 2009, 48, 7457. doi: 10.1021/ie900679m
2. Long, J. P.; Sloan, E. D. Int. J. Thermophys. 1996, 17, 1. doi: 10.1007/BF01448204
3. Hammerschmidt, E. G. Industrial & Engineering Chemistry 1934, 26, 851.
4. Rodger, P. M.; Forester, T. R.; Smith, W. Fluid Phase Equilib. 1996, 116, 326. doi: 10.1016/0378-3812(95)02903-6
5. Carver, T. J.; Drew, M. G. B.; Rodger, P. M. Phys. Chem. Chem. Phys. 1999, 1, 1807.
6. Storr, M. T.; Taylor, P. C.; Monfort, J. P.; Rodger, P. M. J. Am. Chem. Soc. 2004, 126, 1569. doi: 10.1021/ja035243g
7. Hawtin, R. W.; Rodger, P. M. J. Mater. Chem. 2006, 16, 1934. doi: 10.1039/b600285b
8. Moon, C.; Hawtin, R. W.; Rodger, P. M. Faraday Discuss. 2007, 136, 367. doi: 10.1039/b618194p
9. Zhang, J.; Hawtin, R. W.; Yang, Y.; Nakagava, E.; Rivero, M.; Choi, S. K.; Rodger, P. M. J. Phys. Chem. B 2008, 112, 10608. doi: 10.1021/jp076904p
10. Kvamme, B.; Huseby, G.; Forrisdahl, O. K. Mol. Phys. 1997, 90, 979.
11. Kvamme, B.; Kuznetsova, T.; Aasoldsen, K. J. Mol. Graph. Model. 2005, 23, 13.
12. Kuznetsova, T.; Sapronova, A.; Kvamme, B.; Johannsen, K.; Haug, J. Macromol. Symp. 2010, 287, 168. doi: 10.1002/ masy.201050124
13. Wan, L. H.; Yan, K. F.; Li, X. S.; Fan, S. S. Acta Phys. -Chim. Sin. 2009, 25, 486. doi: 10.3866/PKU.WHXB20090315
14. Balbuena, D. A. G.; Balbuena, P. B. J. Phys. Chem. C 2007, 111, 15554. doi: 10.1021/jp071959c
15. Anderson, B. J.; Radhakrishnan, R.; Tester, J. W.; Trout, B. L. Abstr. Am. Chem. Soc. 2005, 229, U593.
16. Zhang, M.; Anderson, B. J.; Warzinski, R. P.; Holder, G. D. Molecular Dynamics Simulation of Hydrate Lattice Distortion. Prepr. Pap. Am. Chem. Soc., Div. Fuel Chem., Salt Lake City, 2009; p 237.
17. Colle, K. S.; Oelfke, R. H.; Kelland, M. A. Polymer contg. amide unit used for inhibiting formation of gas hydrate(s) in e.g. oil or gas pipeline; GB Patent 2301824-A, 1996-12-18.
18. Karaaslan, U.; Parlaktuna, M. Energy & Fuels 2002, 16, 1387. doi: 10.1021/ef0200222
19. Geng, C. Y.; Wen, H.; Zhou, H. J. Phys. Chem. A 2009, 113, 5463. doi: 10.1021/jp811474m
20. Kirchner, M. T.; Boese, R.; Billups, W. E.; Norman, L. R. J. Am. Chem. Soc. 2004, 126, 9407. doi: 10.1021/ja049247c
21. McMullan, R. K.; Jeffrey, G. A. J. Chem. Phys. 1965, 42, 2725. doi: 10.1063/1.1703228
22. Berendsen, H. J. C.; Grigera, J. R.; Straatsma, T. P. J. Phys. Chem. 1987, 91, 6269. doi: 10.1021/j100308a038
23. Materials Studio, Version 4.4; Accelrys Software Inc: San Diego, 2008.
24. Tse, J. S.; Klein, M. L.; McDonald, I. R. J. Phys. Chem. 1983, 87, 4198. doi: 10.1021/j100244a044
25. Moon, C.; Taylor, P. C.; Rodger, P. M. J. Am. Chem. Soc. 2003, 125, 4706. doi: 10.1021/ja028537v
26. Kelland, M. A. J. Appl. Polym. Sci. 2011, 121, 2282. doi: 10.1002/app.33942
27. Ajiro, H.; Takemoto, Y.; Akashi, M.; Chua, P. C.; Kelland, M. A. Energy & Fuels 2010, 24, 6400. doi: 10.1021/ef101107r
28. Chen, Y. J.; Wang, Y. H.; Fan, S. S.; Lang, X. M. Acta Chimica Sinica 2010, 68, 2253.