Water adsorption on Ti-doped silicon clusters

Physical Review B - Condensed Matter and Materials Physics

Volumn 70, Issue 19, 2004, Pages 1-4

  Kawamura, Hiroaki ^a,b   Kumar, Vijay ^a,c   Kawazoe, Yoshiyuki ^a  

^a TOHOKU UNIVERSITY   (Japan)

^b TORAY INDUSTRIES INC   (Japan)

^c Dr Vijay Kumar Foundation   (India)

Author keywords

[No Author keywords available]

Indexed keywords

METAL; SILICON; TITANIUM; WATER;

AB INITIO CALCULATION; ADSORPTION; ARTICLE; BINDING AFFINITY; CHEMICAL REACTION;

EID: 12344334334     PISSN: 01631829     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevB.70.193402     Document Type: Article

References (24)

1. V. Kumar and Y. Kawazoe, Phys. Rev. Lett. 87, 045503 (2001); 91, 199901 (2003); V. Kumar, Eur. Phys. J. D 24, 227 (2003); V. Kumar, Comput. Mater. Sci. 30, 260 (2004).
2. V. Kumar and Y. Kawazoe, Phys. Rev. Lett. 87, 045503 (2001); 91, 199901 (2003); V. Kumar, Eur. Phys. J. D 24, 227 (2003); V. Kumar, Comput. Mater. Sci. 30, 260 (2004).
3. V. Kumar and Y. Kawazoe, Phys. Rev. Lett. 87, 045503 (2001); 91, 199901 (2003); V. Kumar, Eur. Phys. J. D 24, 227 (2003); V. Kumar, Comput. Mater. Sci. 30, 260 (2004).
4. V. Kumar and Y. Kawazoe, Phys. Rev. Lett. 87, 045503 (2001); 91, 199901 (2003); V. Kumar, Eur. Phys. J. D 24, 227 (2003); V. Kumar, Comput. Mater. Sci. 30, 260 (2004).
5. V. Kumar and Y. Kawazoe, Phys. Rev. B 65, 073404 (2002); V. Kumar and Y. Kawazoe, Appl. Phys. Lett. 83, 2677 (2003); V. Kumar et al., Nano Lett. 4, 677 (2004).
6. V. Kumar and Y. Kawazoe, Phys. Rev. B 65, 073404 (2002); V. Kumar and Y. Kawazoe, Appl. Phys. Lett. 83, 2677 (2003); V. Kumar et al., Nano Lett. 4, 677 (2004).
7. V. Kumar and Y. Kawazoe, Phys. Rev. B 65, 073404 (2002); V. Kumar and Y. Kawazoe, Appl. Phys. Lett. 83, 2677 (2003); V. Kumar et al., Nano Lett. 4, 677 (2004).
8. V. Kumar and Y. Kawazoe, Phys. Rev. Lett. 90, 055502 (2003).
9. S. N. Khanna et al., Phys. Rev. Lett. 89, 016803 (2002).
10. S. N. Khanna et al., Chem. Phys. Lett. 373, 433 (2003).
11. G. Mpourmpakis et al., Phys. Rev. B 68, 125407 (2003).
12. J. Lu and S. Nagase, Phys. Rev. Lett. 90, 115506 (2003).
13. F. Hagelberg et al., Phys. Rev. B 67, 035426 (2003).
14. P. Sen and L. Mitas, Phys. Rev. B 68, 155404 (2003).
15. G. Mpourmpakis et al., J. Chem. Phys. 119, 7498 (2003).
16. S. M. Beck, J. Chem. Phys. 90, 6306 (1989).
17. H. Hiura et al., Phys. Rev. Lett. 86, 1733 (2001).
18. V. Kumar et al., Phys. Rev. B 68, 155412 (2003).
19. M. Ohara et al., Chem. Phys. Lett. 371, 490 (2003).
20. G. Kresse and J. Furthmüller, Phys. Rev. B 54, 11169 (1996); G. Kresse and J. Hafner, J. Phys.: Condens. Matter 6, 8245 (1994).
21. G. Kresse and J. Furthmüller, Phys. Rev. B 54, 11169 (1996); G. Kresse and J. Hafner, J. Phys.: Condens. Matter 6, 8245 (1994).
22. D. Vanderbilt, Phys. Rev. B 41, 7892 (1990).
23. J. P. Perdew and Y. Wang, Phys. Rev. B 45, 13244 (1992).
24. H. Kawamura, V. Kumar, and Y. Kawazoe, Phys. Rev. B (to be published).