Time-dependent quantum dynamics study of the Ne + H2+ (v = 0-9) and D2+ (v = 0-12) proton transfer reactions at thermal collision energies

Journal of Physical Chemistry A

Volumn 113, Issue 16, 2009, Pages 4105-4109

  Mayneris Perxachs, Jordi ^a   González, Miguel ^a  

^a UNIVERSITY OF BARCELONA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

CENTRIFUGAL SUDDEN; CROSS SECTION; EXPERIMENTAL DATA; LOW-TO-HIGH; PROTON TRANSFER REACTIONS; QUANTUM DYNAMICS; REACTION PROBABILITY; RELATED SYSTEMS; THERMAL COLLISION ENERGY; TIME-DEPENDENT; TIME-DEPENDENT QUANTUM DYNAMICS; VIBRATIONAL EXCITATION;

CENTRIFUGATION; DEUTERIUM; DYNAMICS; EXCITED STATES; NEON; QUANTUM THEORY;

PROTON TRANSFER;

EID: 65649100450     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp810476w     Document Type: Article

References (26)

1. Dressier, R. A.; Chiu, Y.; Levandier, D. J.; Tang, X. N.; Hou, Y.; Chang, C.; Houchins, C.; Xu, H.; Ng, C. Y. J. Chem. Phys. 2006, 125, 132306.
2. Mayneris, J.; Sierra, J. D.; Gonzalez, M. J. Chem. Phys. 2008, 128, 194307.
3. Bilotta, R. M.; Farrar, J. M. J. Chem. Phys. 1981, 75, 1776.
4. Klein, F. S.; Friedman, L. J. Chem. Phys. 1964, 41, 1789.
5. van Pijkeren, D.; Boltjes, E.; van Eck, J.; Niehaus, A. Chem. Phys. 1984, 91, 293.
6. Herman, Z.; Koyano, I. J. Chem. Soc., Faraday Trans. 1987, 2, 127.
7. Zhang, T.; Qian, X.-M.; Tang, X. N.; Ng, C. Y.; Chiu, Y.; Levandier, D. J.; Miller, J. S.; Dressler, R. A. J. Chem. Phys. 2003, 119, 10175.
8. Urban, J.; Jaquet, R.; Staemmler, V. Int. J. Quantum Chem. 1990, 38, 339.
9. Pendergast, P.; Heck, J. M.; Hayes, E. F.; Jaquet, R. J. Chem. Phys. 1993, 98, 4543.
10. Kress, J. D.; Walker, R. B.; Hayes, E. F.; Pendergast, P. J. Chem. Phys. 1994, 100, 2728.
11. Gilibert, M.; Blasco, R. M.; Gonzalez, M.; Gimenez, X.; Aguilar,A.; Last, I.; Baer, M. J. Phys. Chem. A 1997, 101, 6821.
12. Gilibert, M.; Gimenez, X.; Huarte-Larranaga, F.; Gonzalez, M.;Aguilar, A.; Last, I.; Baer, M. J. Chem. Phys. 1999, 110, 6278. (13) Huarte-Larranaga, F.; Gimenez, X.; Lucas, J. M.; Aguilar, A.;Launay, J.-M. Phys. Chem. Chem. Phys. 1999, 1, 1125.
13. Huarte-Larrañaga F.; Giménez X.; Lucas J.M.; Aguilar A.; Launay J.-M. Phys. Chem. Chem. Phys. 1999, 1, 1125.
14. Huarte-Larranaga, F.; Gimenez, X.; Lucas, J. M.; Aguilar, A.;Launay, J.-M. J. Phys. Chem. A 2000, 104, 10227.
15. Gonzalez, M.; Blasco, R. M.; Gimenez, X.; Aguilar, A. Chem. Phys. 1996, 209, 355.
16. Gray, S. K.; Balint-Kurti, G. G. J. Chem. Phys. 1998, 108, 950.
17. Balint-Kurti, G. G. Adv. Chem. Phys. 2004, 128, 249, and references therein..
18. Miquel, I.; Gonzalez, M.; Sayos, R.; Balint-Kurti, G. G.; Gray, S. K.; Goldfield, E. M. J. Chem. Phys. 2003, 118, 3111.
19. Gamallo, P.; Sayos, R.; Gonzalez, M.; Petrongolo, C.; Defazio, P. J. Chem. Phys. 2006, 124, 174303.
20. Martinez, R.; Sierra, J. D.; Gray, S. K.; Gonzalez, M. J. Chem.Phys. 2006, 125, 164305.
21. Martinez, R.; Gonzalez, M.; Defazio, P.; Petrongolo, C. J. Chem.Phys. 2007, 127, 104302.
22. Mayneris, J.; Martinez, R.; Hernando, J.; Gray, S. K.; Gonzalez,M. J. Chem. Phys. 2008, 128, 144302.
23. Mayneris, J.; Gonzalez, M.; Gray, S. K. Comput^P^ys^CsmmUn. 2008, 179, 741, and references therein..
24. Meijer, A. J. H.; Goldfield, E. M.; Gray, S. K.; Balint-Kurti, G. G. Chem. Phys. Lett. 1998, 293, 270.
25. van Pijkeren, D.; van Eck, J.; Niehaus, A. Chem. Phys. Lett. 1983, 96, 20.
26. Martinez, R.; Sierra, J. D.; Gonzalez, M. J. Chem. Phys. 2005, 123, 174312.