Multidimensional transition-state theory calculations for nuclear dynamics of core-excited molecules

Physical Review A - Atomic, Molecular, and Optical Physics

Volumn 70, Issue 3, 2004, Pages

  Carniato, Stéphane ^a   Ilakovac, Vita ^a,b   Gallet, Jean Jacques ^a   Kukk, Edwin ^c   Luo, Yi ^d  

^a SORBONNE UNIVERSITÉ   (France)

^b UNIVERSITÉ DE CERGY PONTOISE   (France)

^c UNIVERSITY OF OULU   (Finland)

^d ROYAL INSTITUTE OF TECHNOLOGY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION; APPROXIMATION THEORY; BENZENE; FREQUENCIES; IONS; RESONANCE; SYNCHROTRONS; X RAY ANALYSIS;

BENZONITRILE; HIGH-RESOLUTION ANGLE-RESOLVED SPECTROSCOPY; NEAR-EDGE X-RAY ABSORPTION FINE STRUCTURE (NEXAFS); TRANSITION-STATE THEORY;

ELECTRIC EXCITATION;

EID: 19644401250     PISSN: 10502947     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevA.70.032510     Document Type: Article

References (30)

1. F. Gel'mukhanov and H. Ågren, Phys. Rep. 312, 87 (1999).
2. P. A. Brühwiler, O. Karis, and N. Måtensson, Rev. Mod. Phys. 74, 703 (2002).
3. O. Björneholm et al., Phys. Rev. Lett. 68, 1892 (1992).
4. P. Skytt et al., Phys. Rev. Lett. 77, 5035 (1996).
5. A. Cesar et al., J. Chem. Phys. 106, 3439 (1997).
6. S. Sundin et al., Phys. Rev. Lett. 79, 1451 (1997).
7. E. Kukk et al., Phys. Rev. Lett. 76, 3100 (1996).
8. C. Keller et al., Phys. Rev. Lett. 80, 1774 (1998).
9. M. Simon et al., Phys. Rev. Lett. 79, 3857 (1997).
10. J. Adachi et al., J. Chem. Phys. 102, 7369 (1995).
11. P. Salek, F. Gel'mukhanov, and H. Ågren, Phys. Rev. A 59, 1147 (1999).
12. O. Plashkevych et al., Chem. Phys. 260, 11 (2000).
13. P. Morin et al., Phys. Rev. A 61, 050701 (2000).
14. C. Miron et al., J. Chem. Phys. 115, 864 (2001).
15. M. Bassler et al., J. Electron Spectrosc. Relat. Phenom. 101-103, 953 (1999).
16. S. Svensson et al., Rev. Sci. Instrum. 67, 2149 (1996).
17. R. N. S. Sodhi and C. E. Brion, J. Electron Spectrosc. Relat. Phenom. 34, 363 (1984).
18. A. D. Becke, J. Chem. Phys. 98, 5648 (1993).
19. C. Lee, W. Yang, and R. G. Parr, Phys. Rev. B 38, 3098 (1988).
20. W. Kutzelnig, U. Fleisher, and M. Schindler, The IGLO-Method: Ab Initio Calculation and Interpretation of NMR Chemical Shifts and Magnetic Susceptibilities (Springer-Verlag, Heidelberg, 1990), Vol. 23.
21. R. Krishnan, J. S. Binkley, R. Seeger, and J. A. Pople, J. Chem. Phys. 72, 650 (1980).
22. M. W. Schmidt et al., J. Comput. Chem. 14, 1347 (1993).
23. T. Ziegler, A. Rauk, and E. J. Baerends, Theor. Chim. Acta 43, 261 (1977).
24. S. J. Osborne et al., J. Chem. Phys. 106, 1661 (1997).
25. T. D. Thomas et al., J. Chem. Phys. 109, 1041 (1998).
26. L. Triguero et al., J. Electron Spectrosc. Relat. Phenom. 104, 195 (1999).
27. M. Coville and T. Darrah Thomas, Phys. Rev. A 43, 6053 (1991).
28. S. Sundin et al., J. Chem. Phys. 110, 5806 (1999).
29. T. X. Carroll et al., J. Chem. Phys. 116, 10 221 (2002).
30. T. Solomun, K. Christmann, and H. Baumgartel, J. Phys. Chem. 93, 7199 (1989).