Dynamic structure in supported Pt nanoclusters: Real-time density functional theory and x-ray spectroscopy simulations

Physical Review B - Condensed Matter and Materials Physics

Volumn 78, Issue 12, 2008, Pages

  Vila, F ^a   Rehr, J J ^a   Kas, J ^a   Nuzzo, R G ^b   Frenkel, A I ^c  

^a UNIVERSITY OF WASHINGTON   (United States)

^b UNIVERSITY OF ILLINOIS AT URBANA CHAMPAIGN   (United States)

^c YESHIVA UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 52249087140     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.78.121404     Document Type: Article

References (23)

1. F. Baletto and R. Ferrando, Rev. Mod. Phys. RMPHAT 0034-6861 10.1103/RevModPhys.77.371 77, 371 (2005).
2. J. Guzman and B. C. Gates, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja039426e 126, 2672 (2004).
3. M. Oudenhuijzen, J. A. van Bokhoven, J. T. Miller, D. E. Ramaker, and D. C. Konigsberger, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja045286c 127, 1530 (2005).
4. H. Haberland, Clusters of Atoms and Molecules (Springer-Verlag, New York, 1994).
5. J. H. Kang, L. D. Menard, R. G. Nuzzo, and A. I. Frenkel, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja064207p 128, 12068 (2006).
6. L. Menard, J. Phys. Chem. B JPCBFK 1089-5647 10.1021/jp060740f 110, 14564 (2006).
7. S. J. L. Billinge and I. Levin, Science SCIEAS 0036-8075 10.1126/science.1135080 316, 561 (2007).
8. R. Car and M. Parrinello, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.55.2471 55, 2471 (1985).
9. J. S. Tse, Annu. Rev. Phys. Chem. ARPLAP 0066-426X 10.1146/annurev. physchem.53.090401.105737 53, 249 (2002).
10. See EPAPS Document No. E-PRBMDO-78-R08836 for supplementary video clips, figures, and tables. For more information on EPAPS, see http://www.aip.org/ pubservs/epaps.html
11. F. Dzegilenko and E. Herbst, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.466675 100, 9205 (1994).
12. Y. V. Roberts, B. F. G. Johnson, and R. E. Benfield, Inorg. Chim. Acta ICHAA3 0020-1693 10.1016/0020-1693(94)04248-T 229, 221 (1995).
13. Z. Y. Li, N. P. Young, M. D. Vece, S. Palomba, R. E. Palmer, A. L. Bleloch, B. C. Curley, R. L. Johnston, J. Jiang, and J. Yuan, Nature (London) NATUAS 0028-0836 10.1038/nature06470 451, 46 (2008).
14. G. Kresse and J. Furthmüller, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.54.11169 54, 11169 (1996).
15. A. L. Ankudinov, B. Ravel, J. J. Rehr, and S. D. Conradson, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.58.7565 58, 7565 (1998).
16. A. L. Ankudinov, C. E. Bouldin, J. J. Rehr, J. Sims, and H. Hung, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.65.104107 65, 104107 (2002).
17. A. L. Ankudinov, J. J. Rehr, J. J. Low, and S. R. Bare, Top. Catal. TOCAFI 1022-5528 10.1023/A:1013849814153 18, 3 (2002).
18. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865 77, 3865 (1996).
19. L. Wang and D. D. Johnson, J. Am. Chem. Soc. JACSAT 0002-7863 10.1021/ja068750h 129, 3658 (2007).
20. T. Yokoyama, T. Satsukawa, and T. Ohta, Jpn. J. Appl. Phys., Part 1 JAPNDE 0021-4922 10.1143/JJAP.28.1905 28, 1905 (1989).
21. A. I. Frenkel and J. J. Rehr, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.48.585 48, 585 (1993).
22. N. Van Hung and J. J. Rehr, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.56.43 56, 43 (1997).
23. V. F. Petrenko and R. W. Withworth, Physics of Ice (Oxford University Press, New York, 1999).