DFT studies on the nature of coadsorbates on so42- / Au(111)

Zeitschrift fur Physikalische Chemie

Volumn 221, Issue 9-10, 2007, Pages 1393-1406

  Venkatachalam, Sudha ^a   Jacob, Timo ^a  

^a FRITZ HABER INSTITUT DER MAX PLANCK GESELLSCHAFT   (Germany)

Author keywords

Au(111) surface; Density functional theory; Electrochemistry; Hydronium; Sulfate adsorption; Water

Indexed keywords

BINDING ENERGY; ELECTROCHEMISTRY; MOLECULES; MORPHOLOGY; SULFUR COMPOUNDS; WATER;

AU(111) SURFACES; CHARGE DENSITY DISTRIBUTIONS; CO-ADSORPTION; HYDRONIUMS; STABLE CONFIGURATION; SULFATE ADSORPTION; SURFACE-SENSITIVE TECHNIQUE; WATER MOLECULE;

DENSITY FUNCTIONAL THEORY;

EID: 35448929846     PISSN: 09429352     EISSN: None     Source Type: Journal    
DOI: 10.1524/zpch.2007.221.9-10.1393     Document Type: Article

References (22)

1. O. M. Magnussen, J. Hageböck, J. Hotlos, and R. J. Behm, Faraday Discuss. 94 (1992) 329.
2. O. M. Magnussen, Chem. Rev. 102 (2002) 679.
3. G. J. Edens, X. Gao, and M. J. Weaver, J. Electroanal. Chem. 375 (1994) 357.
4. I. R. de Moraes and F. C. Nart, J. Electroanal. Chem. 461 (1999) 110.
5. A. Cuesta, M. Kleinert, and D. M. Kolb, Phys. Chem. Chem. Phys. 2 (2000) 5684.
6. Z. Shi, J. Lipkowski, M. Gamboa, P. Zelenay, and A. Wieckowski, J. Electroanal. Chem. 366 (1994) 317.
7. S. Mirwald, B. Pettinger, and J. Lipkowski, Surf. Sci. 335 (1995) 264.
8. T. Nishizawa, T. Nakada, Y. Kinoshita, S. Miyashita, G. Sazaki, and H. Komatsu, Surf. Sci. 367 (1996) L73.
9. K. Ataka and M. Osawa, Langmuir 14 (1998) 951.
10. Th. Wandlowski, K. Ataka, S. Pronkin, and D. Diesing, Electrochim. Acta 49 (2004) 1233.
11. Y. Shingaya and M. Ito, Electrochim. Acta 44 (1998) 745.
12. Y. Shingaya and M. Ito, J. Electroanal. Chem. 467 (1999) 299.
13. Y. Shingaya and M. Ito, Chem. Phys. Lett. 340 (2001) 425.
14. H. Uchida, M. Hiei, and M. Watanabe, J. Electroanal. Chem. 452 (1998) 97.
15. E. M. Patrito, P. Paredes Olivera, and H. Sellers, Surf. Sci. 380 (1997) 264.
16. M. D. Legault and D. E. Bacelo, J. Phys. Chem. A 106 (2002) 9059.
17. C. G. M. Hermse, A. P. van Bavel, M. T. M. Koper, J. J. Lukkien, R. A. van Santen, and A. P. J. Jansen, Surf. Sci. 572 (2004) 247.
18. C. Verdozzi, P. A. Schultz, R. Wu, A. H. Edwards, and N. Kioussis, Phys. Rev. B 66 (2002) 125 408.
19. J. P. Perdew, K. Burke, and M. Ernzerhof, Phys. Rev. Lett. 88 (1996) 3865.
20. D. R. Hamann, Phys. Rev. B 40 (1989) 2980.
21. S. G. Louie, S. Froyen, and M. L. Cohen, Phys. Rev. B 26 (1982) 1738.
22. T. Jacob and W. A. Goddard III, J. Am. Chem. Soc. 126 (2004) 9360.