First-principles calculations of the geometry and electronic structure of electron- and hole-doped C60 in the field-effect transistor structure

Physical Review B - Condensed Matter and Materials Physics

Volumn 69, Issue 20, 2004, Pages

  Chida, Tadahiko ^a   Suzuki, Shugo ^a   Nakao, Kenji ^a  

^a UNIVERSITY OF TSUKUBA   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; CALCULATION; CHEMICAL BOND; DENSITY FUNCTIONAL THEORY; DISPERSION; ELECTRODE; ELECTRON; ENERGY; GEOMETRY; SEMICONDUCTOR;

EID: 42749104732     PISSN: 01631829     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevB.69.205102     Document Type: Article

References (20)

1. A.F. Hebard, M.J. Rosseinsky, R.C. Haddon, D.W. Murphy, S.H. Glarum, T.T.M. Palstra, A.P. Ramirez, and A.R. Kortan, Nature (London) 350, 600 (1991).
2. K. Tanigaki, T.W. Ebbesen, S. Saito, J. Mizuki, J.S. Tsai, Y. Kubo, and S. Kuroshima, Nature (London) 352, 222 (1991).
3. M.J. Rosseinsky, D.W. Murphy, R.M. Fleming, and O. Zhou, Nature (London) 364, 425 (1993).
4. Q. Zhu, D.E. Cox, J.E. Fischer, K. Kinaz, A.R. McGhie, and O. Zhou, Nature (London) 355, 712 (1992).
5. A.M. Panich, H.M. Vieth, P.K. Ummat, and W.R. Datars, Physica B 327, 102 (2003).
6. R.C. Haddon, A.S. Perel, R.C. Morris, T.T.M. Palstra, A.F. Hebard, and R.M. Fleming, Appl. Phys. Lett. 67, 121 (1995).
7. S. Suzuki and K. Nakao, J. Phys. Soc. Jpn. 66, 3881 (1997).
8. P. Hohenberg and W. Kohn, Phys. Rev. 136, B864 (1964).
9. W. Kohn and L.J. Sham, Phys. Rev. 140, A1133 (1965).
10. J.P Perdew and A. Zunger, Phys. Rev. B 23, 5048 (1981).
11. D.M. Ceperley and B.J. Alder, Phys. Rev. Lett. 45, 566 (1980).
12. M.S. Dresselhaus, G. Dresselhaus, and P.C. Eklund, Science of Fullerenes and Carbon Nanotubes (Academic Press, San Diego, 1996).
13. D.E. Parry, Surf. Sci. 49, 433 (1975).
14. F.E. Harris, Int. J. Quantum Chem. 69, 385 (1998).
15. C.S. Yannoni, P.P. Bernier, D.S. Bethune, G. Meijer, and J.R. Salem, J. Am. Chem. Soc. 113, 3190 (1991).
16. K. Hedberg, L. Hedberg, D.S. Bethuen, C.A. Brown, H.C. Dorn, R.D. Johnson, and M. de Vries, Science 254, 410 (1991).
17. S. Wehrli, D. Poilblanc, and T.M. Rice, Eur. Phys. J. B 23, 345 (2001).
18. A.F. Hebard, R.C. Haddon, R.M. Fleming, and A.R. Kortan, Appl. Phys. Lett. 59, 2109 (1991).
19. S. Saito and A. Oshiyama, Phys. Rev. Lett. 66, 2637 (1991).
20. S. Wehrli, E. Koch, and M. Sigrist, Phys. Rev. B 68, 115412 (2003).