Electronic structure calculations of metal-nanotube contacts with or without oxygen adsorption

Physical Review B - Condensed Matter and Materials Physics

Volumn 72, Issue 4, 2005, Pages

  Park, Noejung ^a   Hong, Suklyun ^b  

^a Dankook University   (South Korea)

^b Sejong University   (South Korea)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 33749233618     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.72.045408     Document Type: Article

References (35)

1. S. Iijima, Nature (London) NATUAS 0028-0836 10.1038/354056a0 354, 56 (1991).
2. S. Frank, P. Poncharal, Z. L. Wang, and W. A. de Heer, Science SCIEAS 0036-8075 10.1126/science.280.5370.1744 280, 1744 (1998).
3. A. Javey, H. Kim, M. Brink, Q. Wang, A. Ural, J. Guo, P. McIntyre, P. McEuen, M. Lundstrom, and H. Dai, Nat. Mater. NMAACR 1476-1122 10.1038/nmat769 1, 241 (2002).
4. A. Javey, J. Guo, Q. Wang, M. Lundstrom, and H. Dai, Nature (London) NATUAS 0028-0836 10.1038/nature01797 424, 654 (2002).
5. S. J. Tans, A. R. M. Verschueren, and C. Dekker, Nature (London) NATUAS 0028-0836 10.1038/29954 393, 49 (1998).
6. S. G. Rao, L. Huang, W. Setyawan, and S. Hong, Nature (London) NATUAS 0028-0836 10.1038/425036a 425, 36 (2003).
7. S. Heinze, J. Tersoff, and Ph. Avouris, Appl. Phys. Lett. APPLAB 0003-6951 10.1063/1.1632531 83, 5038 (2003).
8. J. Appenzeller, J. Knoch, V. Derycke, R. Martel, S. Wind, and Ph. Avouris, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PHYSREVLETT.88.126801 89, 126801 (2002).
9. M. Freitag, M. Radosavljevic, Y. Zhou, A. T. Johnson, and W. F. Smith, Appl. Phys. Lett. APPLAB 0003-6951 10.1063/1.1419055 79, 3326 (2001).
10. V. Derycke, R. Martel, J. Appenzeller, and Ph. Avouris, Appl. Phys. Lett. APPLAB 0003-6951 10.1063/1.1467702 80, 2773 (2002).
11. S. Heinze, J. Tersoff, R. Martel, V. Derycke, J. Appenzeller, and Ph. Avouris, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.89.106801 89, 106801 (2002).
12. P. G. Collins, K. Bradley, M. Ishigami, and Z. Zettl, Science SCIEAS 0036-8075 10.1126/science.287.5459.1801 287, 1801 (2001).
13. G. U. Sumanasekera, C. Adu, S. Fang, and P. C. Eklund, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.85.1096 85, 1096 (2000).
14. S.-H. Jhi, S. G. Louie, and M. L. Cohen, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.85.1710 85, 1710 (2000).
15. H. Ulbricht, G. Moos, and T. Hertel, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.66.075404 66, 075404 (2002).
16. P. Giannozzi, R. Car, and G. Scoles, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1536636 118, 1003 (2003).
17. S. Dag, O. Gülseren, T. Yildirim, and S. Ciraci, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.67.165424 67, 165424 (2003).
18. G. Kresse and J. Hafner, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.47.558 47, R558 (1993);
19. G. Kresse and J. Hafner, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.49.14251 49, 14251 (1994).
20. G. Kresse and J. Furthmüller, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.11169 54, 11169 (1996);
21. G. Kresse and J. Furthmüller, Comput. Mater. Sci. CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0 6, 15 (1996).
22. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865 77, 3865 (1996).
23. G. Kresse and D. Joubert, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.59.1758 59, 1758 (1999).
24. K. Honkala and K. Laasonen, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.84.705 84, 705 (2000).
25. T. Sasaki and T. Ohno, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.60. 7824 60, 7824 (1999).
26. J. Jacobsen, B. Hammer, K. W. Jacobsen, and J. K. Nørskov, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.52.14954 52, 14954 (1995).
27. S. Dag, O. Gülseren, S. Ciraci, and T. Yildirim, Appl. Phys. Lett. APPLAB 0003-6951 10.1063/1.1616662 83, 3180 (2003).
28. H. B. Michaelson, J. Appl. Phys. JAPIAU 0021-8979 10.1063/1.323539 48, 4729 (1977).
29. C. J. Fall, N. Binggeli, and A. Baldereschi, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.58.R7544 58, R7544 (1998).
30. Y. Xue and S. Datta, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.83.4844 83, 4844 (1999).
31. F. Léonard and J. Tersoff, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.84.4693 84, 4693 (2000).
32. T. Yamada, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.69.125408 69, 125408 (2004).
33. B. Shan and K. Cho, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.70. 233405 70, 233405 (2004).
34. M. S. Fuhrer, J. Nygøard, L. Shin, M. Forero, Y.-G. Yoon, M. S. C. Mazzoni, H. J. Choi, J. Ihm, S. G. Louie, A. Zettl, and P. L. McEuen, Science SCIEAS 0036-8075 10.1126/science.288.5465.494 288, 494 (2000).
35. R. L. Liboff, Introductory Quantum Mechanics, 2nd ed. (Addison-Wesley, New York, 1992).