Photoelectron spectroscopy of cold aluminum cluster anions: Comparison with density functional theory results

Journal of Chemical Physics

Volumn 132, Issue 10, 2010, Pages

  Ma, Lei ^a,b   V Issendorff, Bernd ^b   Aguado, Andŕs ^c  

^a NANJING UNIVERSITY   (China)

^b UNIVERSITY OF FREIBURG   (Germany)

^c UNIVERSITY OF VALLADOLID   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ALUMINUM CLUSTERS; CLUSTER GEOMETRIES; DENSITY FUNCTIONAL THEORY CALCULATIONS; DENSITY OF STATE; DISORDERED STRUCTURES; ELECTRON SHELLS; PHOTOELECTRON SPECTRUM; SIZE RANGES; STRUCTURAL MOTIFS;

ALUMINUM; ELECTRONIC STRUCTURE; PHOTOELECTRON SPECTROSCOPY; PHOTOIONIZATION; PHOTONS;

DENSITY FUNCTIONAL THEORY;

EID: 77949575625     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3352445     Document Type: Article

References (41)

1. N. W. Ashcroft and N. D. Mermin, Solid State Physics (Saunders College, Philadelphia, 1976).
2. H. J. Levinson, F. Greuter, and E. W. Plummer, Phys. Rev. B PRBMDO 0163-1829 27, 727 (1983). 10.1103/PhysRevB.27.727
3. N. W. Ashcroft, Phys. Rev. B PRBMDO 0163-1829 19, 4906 (1979). 10.1103/PhysRevB.19.4906
4. K. E. Schriver, J. L. Persson, E. C. Honea, and R. L. Whetten, Phys. Rev. Lett. PRLTAO 0031-9007 64, 2539 (1990). 10.1103/PhysRevLett.64.2539
5. J. Martins, R. Car, and J. Buttet, Surf. Sci. SUSCAS 0039-6028 106, 265 (1981). 10.1016/0039-6028(81)90210-7
6. W. Ekardt, Phys. Rev. B PRBMDO 0163-1829 29, 1558 (1984). 10.1103/PhysRevB.29.1558
7. T. H. Upton, Phys. Rev. Lett. PRLTAO 0031-9007 56, 2168 (1986). 10.1103/PhysRevLett.56.2168
8. G. Ganteför and W. Eberhardt, Chem. Phys. Lett. CHPLBC 0009-2614 217, 600 (1994). 10.1016/0009-2614(93)E1436-K
9. C. -Y. Cha, G. Ganteför, and W. Eberhardt, J. Chem. Phys. JCPSA6 0021-9606 100, 995 (1994). 10.1063/1.466582
10. W. A. de Heer, P. Milani, and A. Châtelain, Phys. Rev. Lett. PRLTAO 0031-9007 63, 2834 (1989). 10.1103/PhysRevLett.63.2834
11. M. F. Jarrold and J. E. Bower, J. Chem. Phys. JCPSA6 0021-9606 98, 2399 (1993). 10.1063/1.464167
12. K. J. Taylor, C. L. Pettiette, M. J. Craycraft, O. Chesnovsky, and R. E. Smalley, Chem. Phys. Lett. CHPLBC 0009-2614 152, 347 (1988). 10.1016/0009-2614(88)80104-0
13. X. Li, H. Wu, X. B. Wang, and L. S. Wang, Phys. Rev. Lett. PRLTAO 0031-9007 81, 1909 (1998). 10.1103/PhysRevLett.81.1909
14. G. Wrigge, M. A. Hoffmann, and B. v. Issendorff, Phys. Rev. A PLRAAN 1050-2947 65, 063201 (2002). 10.1103/PhysRevA.65.063201
15. O. Kostko, B. Huber, M. Moseler, and B. v. Issendorff, Phys. Rev. Lett. PRLTAO 0031-9007 98, 043401 (2007). 10.1103/PhysRevLett.98.043401 (Pubitemid 46155098)
16. B. Baguenard, M. Pellarin, J. Lerḿ, J. L. Vialle, and M. Broyer, J. Chem. Phys. JCPSA6 0021-9606 100, 754 (1994). 10.1063/1.466894
17. T. P. Martin, U. Näher, and H. Schaber, Chem. Phys. Lett. CHPLBC 0009-2614 199, 470 (1992). 10.1016/0009-2614(92)87029-O
18. A. K. Starace, C. M. Neal, B. Cao, M. F. Jarrold, A. Aguado, and J. M. López, J. Chem. Phys. JCPSA6 0021-9606 131, 044307 (2009). 10.1063/1.3157263
19. R. O. Jones, J. Chem. Phys. JCPSA6 0021-9606 99, 1194 (1993). 10.1063/1.465363
20. B. K. Rao and P. Jena, J. Chem. Phys. JCPSA6 0021-9606 111, 1890 (1999). 10.1063/1.479458
21. A. Aguado and J. M. López, J. Phys. Chem. B JPCBFK 1089-5647 110, 14020 (2006). 10.1021/jp0630166 (Pubitemid 44187952)
22. F. -C. Chuang, C. Z. Wang, and K. H. Ho, Phys. Rev. B PRBMDO 0163-1829 73, 125431 (2006). 10.1103/PhysRevB.73.125431
23. A. K. Starace, C. M. Neal, B. Cao, M. F. Jarrold, A. Aguado, and J. M. López, J. Chem. Phys. JCPSA6 0021-9606 129, 144702 (2008). 10.1063/1.2987720
24. J. Sun, W. -C. Lu, Z. -S. Li, C. -Z. Wang, and K. M. Ho, J. Chem. Phys. JCPSA6 0021-9606 129, 014707 (2008). 10.1063/1.2946695
25. W. Zhang, W. -C. Lu, J. Sun, C. Z. Wang, and K. M. Ho, Chem. Phys. Lett. CHPLBC 0009-2614 455, 232 (2008). 10.1016/j.cplett.2008.01.070
26. A. Aguado and J. M. López, J. Chem. Phys. JCPSA6 0021-9606 130, 064704 (2009). 10.1063/1.3075834
27. W. Zhang, W. -C. Lu, Q. -J. Zang, C. Z. Wang, and K. M. Ho, J. Chem. Phys. JCPSA6 0021-9606 130, 144701 (2009). 10.1063/1.3090485
28. J. Akola, M. Manninen, H. Häkkinen, U. Landman, X. Li, and L. -S. Wang, Phys. Rev. B PRBMDO 0163-1829 60, R11297 (1999). 10.1103/PhysRevB.60. R11297
29. J. Akola, M. Manninen, H. Häkkinen, U. Landman, X. Li, and L. -S. Wang, Phys. Rev. B PRBMDO 0163-1829 62, 13216 (2000). 10.1103/PhysRevB.62.13216
30. D. Gerlich, Adv. Chem. Phys. ADCPAA 0065-2385 82, 1 (1992). 10.1002/9780470141397.ch1
31. W. Kohn and L. J. Sham, Phys. Rev. PRVAAH 0096-8250 140, A1133 (1965). 10.1103/PhysRev.140.A1133
32. J. M. Soler, E. Artacho, J. D. Gale, A. Garcia, J. Junquera, P. Ordejón, and D. Sánchez-Portal, J. Phys.: Condens. Matter JCOMEL 0953-8984 14, 2745 (2002). 10.1088/0953-8984/14/11/302 (Pubitemid 34288362)
33. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. PRLTAO 0031-9007 77, 3865 (1996). 10.1103/PhysRevLett.77.3865
34. D. R. Hamann, M. Schlüter, and C. Chiang, Phys. Rev. Lett. PRLTAO 0031-9007 43, 1494 (1979). 10.1103/PhysRevLett.43.1494
35. L. Kleinman and D. M. Bylander, Phys. Rev. Lett. PRLTAO 0031-9007 48, 1425 (1982). 10.1103/PhysRevLett.48.1425
36. R. L. Hettich, J. Am. Chem. Soc. JACSAT 0002-7863 111, 8582 (1989). 10.1021/ja00205a004
37. See supplementary material at http://dx.doi.org/10.1063/1.3352445 E-JCPSA6-132-023010 for the coordinate files.
38. Web page of the "Nanometric Properties of Matter" research group (http://metodos.fam.cie.uva.es/GIR).
39. H. Cheng, R. S. Berry, and R. L. Whetten, Phys. Rev. B PRBMDO 0163-1829 43, 10647 (1991). 10.1103/PhysRevB.43.10647
40. T. H. Upton, J. Chem. Phys. JCPSA6 0021-9606 86, 7054 (1987). 10.1063/1.452764
41. R. Kubo, J. Phys. Soc. Jpn. JUPSAU 0031-9015 17, 975 (1962). 10.1143/JPSJ.17.975