Modeling of FS2+ center at the magnesium oxide (1 0 0) hydrated surface

Chemical Physics Letters

Volumn 391, Issue 1-3, 2004, Pages 120-123

  Menetrey M ^a   Markovits, A ^a   Minot, C ^a  

^a LABORATOIRE DE CHIMIE THÉORIQUE   (France)

Author keywords

[No Author keywords available]

Indexed keywords

FLUORINE DERIVATIVE; MAGNESIUM OXIDE; OXYGEN;

ACCELERATION; ARTICLE; CHEMICAL STRUCTURE; ELECTRON; HYDRATION; MATHEMATICAL ANALYSIS; STRUCTURE ANALYSIS; SURFACE PROPERTY;

EID: 2542466037     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.04.090     Document Type: Article

References (19)

1. Pacchioni G. Chem. Phys. Chem. 4:2003;1041
2. Chiesa M., Paganini M.C., Giamello E., Murphy D.M., Sojka Z. J. Chem. Phys. 116:2002;4266
3. Chiesa M., Paganini M.C., Giamello E., Soave R., Pacchioni G., Murphy D.M., Sojka Z. J. Phys. Chem. B. 105:2001;497
4. Chiesa M., Paganini M.C., Giamello E., Valentin C.d., Pacchioni G. Angew. Chem. Int. Ed. 42:2003;1759
5. Risse T., Schmidt J., Hamann H., Freund H.J. Angew. Chem. Int. Ed. 41:2002;1517
6. Tench A.J., Nelson R.L. J. Colloid Interf. Sci. 26:1968;364
7. Tench A.J. Surf. Sci. 25:1971;625
8. Mori-Sanchez P., Recio J.M., Silvi B., Sousa C., Martin_Pendas A., Luana V., Illas F. Phys. Rev. B. 66:2002;75103
9. Coluccia S., Lavagnino S., Marchese L. Mater. Chem. Phys. 95:1991;9385
10. Scorza E., Birkenheuer U., Pisani C. J. Chem. Phys. 107:1997;9645
11. Ferrari A.M., Pacchioni G. J. Phys. Chem. 99:1995;17010
12. Ménétrey M., Markovits A., Minot C., Vitto A.D., Pacchioni G. Surf. Sci. 549:2004;294
13. M. Ménétrey, A. Markovits, C. Minot, G. Pacchioni, J. Phys. Chem. B (submitted)
14. Kresse G., Hafner J. Phys. Rev. B. 47:1993;558
15. Kresse G., Hafner J. Phys. Rev. B. 48:1993;13115
16. Kresse G., Hafner J. Phys. Rev. B. 49:1994;14251
17. Vanderbilt D. Phys. Rev. B. 41:1990;7892
18. Kresse G., Hafner J. J. Phys.: Condens. Matter. 6:1994;8245
19. Perdew J.P., Wang Y. Phys. Rev. B. 45:1992;13244