Theoretical study of the 13C NMR spectroscopy of single-walled carbon nanotubes

Journal of the American Chemical Society

Volumn 127, Issue 50, 2005, Pages 17948-17953

  Besley, Nicholas A ^a   Titman, Jeremy J ^a   Wright, Matthew D ^a  

^a UNIVERSITY OF NOTTINGHAM   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; MOLECULAR STRUCTURE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; STEREOCHEMISTRY;

CHEMICAL SHIFTS; CHIRALITY; SINGLE-WALLED CARBON NANOTUBES;

CARBON NANOTUBES;

CARBON; CARBON NANOTUBE;

AB INITIO CALCULATION; ARTICLE; CARBON NUCLEAR MAGNETIC RESONANCE; CHIRALITY; DENSITY FUNCTIONAL THEORY; QUANTUM MECHANICS; STRUCTURE ANALYSIS; THEORETICAL STUDY;

EID: 29344440478     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja055888b     Document Type: Article

References (23)

1. Iijima, S. Nature 1991, 354, 56-58.
2. Iijima, S.; Ichihashi, T. Nature 1993, 363, 603-605.
3. Wilder, J. W. G.; Venema, L. C.; Rinzler, A. G.; Smalley, R. E.; Dekker, C. Nature 1998, 391, 59-62.
4. Odom, T. W.; Huang, J. L.; Kim, P.; Lieber, C. M. Nature 1998, 391, 62-64.
5. Marinopoulos, A. G.; Reining, L.; Rubio, A.; Vast, N. Appl. Phys. A 2004, 78, 1157-1168.
6. Weisman, R. B.; Bachilo, S. M.; Tsyboulski, D. Appl. Phys. A 2004, 78, 1111-1116.
7. Dresselhaus, M. S.; Dresselhaus, G.; Saito, R.; Jorio, A. Phys. Rep. 2005, 409, 47-99.
8. Tang, X.-P.; Kleinhammes, A.; Shimoda, H.; Fleming, L.; Bennoune, K. Y.; Sinha, S.; Bower, C.; Zhou, O.; Wu, Y. Science 2000, 288, 492-494.
9. Goze-Bac, C.; Latil, S.; Lauginie, P.; Jourdain, V.; Conard, J.; Duclaux, L.; Rubio, A.; Bernier, P. Carbon 2002, 40, 1825-1842.
10. Hayashi, S.; Hoshi, F.; Ishikura, T.; Yumura, M.; Ohshima, S. Carbon 2003, 41, 3047-3056.
11. Kitaygorodskiy, A.; Wang, W.; Xie, S.-Y.; Lin, Y.; Shiral Fernando, K. A.; Wang, X.; Qu, L.; Chen, B.; Sun, Y.-P. J. Am. Chem. Soc. 2005, 127, 7517-7520.
12. Goze Bac, C.; Latil, S.; Vaccarini, P.; Bernier, P.; Gaveau, P.; Tahir, S.; Micholet, V.; Aznar, R.; Rubio, A.; Metenier, K.; Beguin, F. Phys. Rev. B 2001, 63, 100302.
13. Chen, J.; Liu, H.; Weimer. W. A.; Halls, M. D.; Waldeck, D. H.; Walker, G. C. J. Am. Chem. Soc. 2002, 124, 9034-9035.
14. Kleinhammes, A.; Mao, S.-H.; Yang, X.-J.; Tang, X.-P.; Shimoda, H.; Lu, J. P.; Zhou, O.; Wu, Y. Phys. Rev. B 2003, 68, 075418.
15. Ruther, M. G.; Frehill, F.; O'Brian, J. E.; Minett, A. I.; Blau, W. J.; Vos, J. G.; in het Panhuis, M. J. Phys. Chem. B 2004, 108, 9665-9668.
16. Latil, S.; Henrard, L.; Goze-Bac, C.; Bernier, P.; Rubio, A. Phys. Rev. Lett. 2001, 86, 3160-3163.
17. Zurek, E.; Autschbach, J. J. Am. Chem. Soc. 2004, 126, 13079-13088.
18. Ditchfield, R. Mol. Phys. 1974, 27, 789-807.
19. Wolinski, K.; Hinton, J. F.; Pulay, P. J. Chem. Phys. 1990, 112, 8251-8260.
20. Haser, M.; Ahlrichs, R.; Baron, H. P.; Weiss, P.; Horn, H. Theor. Chim. Acta 1992, 83, 455-470.
21. Cioslowski, J.; Rao, N.; Moncrieff, D. J. Am. Chem. Soc. 2002, 124, 8485-8489.
22. Kong, J.; et al. J. Comput. Chem. 2000, 21, 1532-1548.
23. Ouyang, M.; Huang, J. L.; Cheung, C. L.; Lieber, C. M. Science 2001, 292, 702.