Structural and electronic properties of C6 cluster

European Physical Journal D

Volumn 34, Issue 1-3, 2005, Pages 59-61

  Zhang, D ^a   Jin, F ^a   Yuan, J ^a  

^a NATIONAL UNIVERSITY OF DEFENSE TECHNOLOGY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; ELECTRONIC PROPERTIES; GROUND STATE;

ATOMIC CONFIGURATION; BOND ANGLE; FIRST PRINCIPLES TOTAL ENERGY CALCULATIONS; FULL POTENTIAL AUGMENTED PLANE WAVE PLUS LOCAL ORBITALS METHOD; GENERALIZED GRADIENT APPROXIMATIONS; GEOMETRY OPTIMIZATION; HEXAGONAL CONFIGURATION; MONOCYCLICS; NEWTON'S DYNAMICS; STRUCTURAL AND ELECTRONIC PROPERTIES;

BOND LENGTH;

EID: 23744497542     PISSN: 14346060     EISSN: 14346079     Source Type: Journal    
DOI: 10.1140/epjd/e2005-00119-4     Document Type: Conference Paper

References (19)

1. V.L. Colvin, M.C. Schlamp, A.P. Alivisations, Nature 370, 354 (1994)
2. B.O. Dabbousi, M.G. Bawendi, O. Onitsuka, M.F. Rubner, Appl. Phys. Lett. 66, 1316 (1995)
3. B.X. Li, P.L. Cao, Phys. Rev. B 62, 15 (2000)
4. V.G. Grigoryan, M. Springborg, Phys. Chem. Chem. Phys. 3, 5135 (2001)
5. J.L. Wang et al., Solid State Commun. 117, 593 (2001)
6. K. Sunmathi, K. Balasubramanian, Chem. Phys. Lett. 193, 251 (1992)
7. M.L. Martin, El-Yazal Jamal, J.-P. Francois, Chem. Phys. Lett. 242, 570 (1995)
8. K. Takayanagi et al., Surf. Sci. 164, 367 (1985)
9. E.C. Hon et al., Nature 366, 42 (1993)
10. O. Cheshnovsky et al., Chem. Phys. Lett. 138, 119 (1987)
11. J.R. Chelikovsky, J. Phys. D 33, R33 (2000)
12. D.J. Singh, Planewaves, Pseudopotentials and the LAPW method (Kluwer Academic Publishers, Boston, 1994), p. 34
13. P. Blaha et al., Comput. Phys. Commun. 147, 71 (2002)
14. J.P. Perdew, K. Burk, M. Ernzerhof, Phys. Rev. Lett. 77, 3865 (1996)
15. X.L. Zhou, Y.L. Bai, X.R. Cheng, X.D. Yang, Chin. Phys. Lett. 21, 283 (2004)
16. K. Raghavachari, J.S. Blinkley, J. Chem. Phys. 87, 2191 (1987)
17. J. Hutter, H.P. Löthi, F. Diederich, J. Am. Chem. Soc. 116, 750 (1994)
18. P. Hohenberg, W. Kohn, Phys. Rev. B 136, 864 (1964)
19. W. Kohn, L.J. Sham, Phys. Rev. A 140, 1133 (1965)