Quantum dynamic of sticking of a H atom on a graphite surface

Journal of Chemical Physics

Volumn 129, Issue 2, 2008, Pages

  Morisset, S ^a   Allouche, A ^a  

^a CNRS   (France)

Author keywords

[No Author keywords available]

Indexed keywords

ATMOSPHERIC TEMPERATURE; ATOMIC PHYSICS; ATOMS; CARBON; CHEMISORPTION; GEOPHYSICAL PROSPECTING; GRAPHITE; HYDROGEN; NONMETALS; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; SURFACE PROPERTIES; WAVE EQUATIONS;

AMERICAN INSTITUTE OF PHYSICS (AIP); DENSITY-FUNCTIONAL THEORY (DFT); GRAPHITE SURFACES; HYDROGEN ATOMS; INCIDENT ENERGIES; NEW MODEL; PHONON MODES; QUANTUM DYNAMIC; QUANTUM STUDY; SCATTERING APPROXIMATION; STICKING COEFFICIENTS; SURFACE TEMPERATURES; SYSTEM DYNAMICS (SD); VIBRATIONAL MODE (VM); WAVE-PACKET METHODS;

DENSITY FUNCTIONAL THEORY;

EID: 47249159374     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2952685     Document Type: Article

References (31)

1. Y. Ferro, F. Marinelli, and A. Allouche, Chem. Phys. Lett. 368, 609 (2003).
2. X. Sha, B. Jackson, and D. Lemoine, J. Chem. Phys. 116, 7158 (2002).
3. L. Jeloaica and V. Sidis, Chem. Phys. Lett. 300, 157 (1999).
4. C. Brosset and H. J. Khodja, J. Nucl. Mater. 337, 664 (2005).
5. H. Atsumi, J. Nucl. Mater. 313, 543 (2003).
6. C. Brosset and A. Allouche, L'actualit́ Chimique 0151-9093 289, 5 (2005).
7. T. Zecho, A. Güttler, X. Sha, B. Jackson, and J. Kuppers, J. Chem. Phys. 117, 8486 (2002).
8. X. Sha, B. Jackson, D. Lemoine, and B. Lepetit, J. Chem. Phys. 122, 014709 (2005).
9. J. Kerwin, X. Sha, and B. Jackson, J. Phys. Chem. B 110, 18811 (2006).
10. B. Jackson, J. Chem. Phys. 88, 1383 (1988).
11. B. Jackson, J. Chem. Phys. 89, 2473 (1988).
12. B. Jackson, J. Chem. Phys. 97, 6792 (1992).
13. D. J. Kouri and R. C. Mowrey, J. Chem. Phys. 86, 2087 (1986).
14. R. C. Mowrey and D. J. Kouri, J. Chem. Phys. 84, 6466 (1986).
15. R. C. Mowrey and D. J. Kouri, J. Chem. Phys. 86, 6140 (1987).
16. V. Bortolani, A. Franchini, N. Garcia, F. Nizzoli, and G. Santoro, Phys. Rev. B 28, 7358 (1983).
17. M. D. Stiles, J. W. Wilkins, and M. Persson, Phys. Rev. B 34, 4490 (1986).
18. M. D. Stiles and J. W. Wilkins, Phys. Rev. B 37, 7306 (1988).
19. Y. Ferro, F. Marinelli, and A. Allouche, J. Chem. Phys. 116, 8124 (2002).
20. S. Baroni, A. Dal Corso, and S. de Gironcoli, http://www.pwscf.org/
21. N. W. Ashcroft and N. D. Mermin, Solid State Physics (Holt, Rinehart and Winston, New York, 1976).
22. C. Cohen-Tannoudji, B. Diu, and F. Laloe, Quantum Mechanics I (Wiley, New York, 1977).
23. J. Qian, D. C. Jacobs, and D. J. Tannor, J. Chem. Phys. 103, 10764 (1995).
24. C. Leforestier, R. H. Bisseling, C. Cerjan, J. Comput. Phys. 94, 59 (1991).
25. D. Kosloff and R. Kosloff, J. Comput. Phys. 52, 35 (1983).
26. C. Leforestier and R. E. Wyatt, J. Chem. Phys. 78, 2334 (1983).
27. D. Neuhauser and M. Baer, J. Chem. Phys. 90, 4351 (1989).
28. G. C. Balint-Kurti, R. N. Dixon, and C. C. Marston, J. Chem. Soc., Faraday Trans. 86, 1740 (1990).
29. D. H. Zhang, Q. Wu, and J. Z. H. Zhang, J. Chem. Phys. 102, 124 (1995).
30. A. Allouche, Y. Ferro, T. Angot, C. Thomas, and J. M. Layet, J. Chem. Phys. 123, 124701 (2005).
31. J. Kerwin and B. Jackson, J. Chem. Phys. 128, 084702 (2008).