An ab initio study of the electronic spectrum of Zn2 including spin-orbit coupling

Chemical Physics

Volumn 311, Issue 1-2 SPEC.ISS., 2005, Pages 35-44

  Ellingsen, K ^a   Saue, T ^a   Pouchan, C ^b   Gropen, O ^a  

^a UNIVERSITY OF TROMSØ   (Norway)

^b UNIVERSITÉ DE PAU ET DES PAYS DE L'ADOUR   (France)

Author keywords

[No Author keywords available]

Indexed keywords

DIMER; ZINC;

AB INITIO CALCULATION; ARTICLE; ATOM; ATOMIC ABSORPTION; DIPOLE; DISSOCIATION; ELECTRON; EXPERIMENT; SPECTRUM;

EID: 14544281501     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2004.09.038     Document Type: Article

References (31)

1. W. Kedzierski, J.B. Atkinson, and L. Krause Chem. Phys. Lett. 215 1993 185
2. W. Kedzierski, J.B. Atkinson, and L. Krause Opt. Lett. 14 1989 607
3. W. Kedzierski, J.B. Atkinson, and L. Krause Chem. Phys. Lett. 222 1994 146
4. M. Czajkowski, R. Bobkowski, and L. Krause Phys. Rev. A 41 1990 277
5. W. Kedzierski, J.B. Atkinson, and L. Krause Chem. Phys. Lett. 200 1992 103
6. M.A. Czajkowski, and J. Koperski Spectrochim. Acta A 55 1999 2221
7. G. Rodriguez, and J.G. Eden J. Chem. Phys. 41 1995 95
8. C.H. Su, P.-K. Liao, Y. Huang, S.-S. Liou, and R.F. Brebick J. Chem. Phys. 81 1984 11
9. H. Hamada Philos. Mag. 31 1931 50
10. A. Aguado, J.M. GarciadelaVega, and B. Miguel J. Chem. Soc., Faraday Trans. 93 1997
11. M. Yu, and M. Dolg Chem. Phys. Lett. 273 1997 329
12. F. Schautz, H.-J. Flad, and M. Dolg Theor. Chem. Acc. 99 1998 231 29
13. E. Czhucaj, F. Rebentrost, H. Stoll, and H. Preuss Chem. Phys. Lett. 225 1996 203
14. P.J. Hay, T.H. Dunning Jr., and R.C. Raffenetti J. Chem. Phys. 65 1976 2679
15. H. Tatewaki, M. Tomonari, and T. Nakamura J. Chem. Phys. 82 1985 5608
16. C.F. Bender, T.N. Rescigno, H.F. Schaefer, and A.E. Orel J. Chem. Phys. 71 1979 1122
17. M.D. Morse Chem. Rev. 86 1986 1049
18. J. Koperski Phys. Rep. 369 2002 177
19. Y. Wang, H.-J. Flad, and M. Dolg J. Phys. Chem. A 104 2000 5558
20. K. Andersson, M.R.A. Blomberg, M.P. Fülscher, G. Karlström, R. Lindh, P.-Å. Malmqvist, P. Neogrády, J. Olsen, B.O. Roos, A.J. Sadlej, M. Schütz, L. Seijo, L. Serrano-Andrés, P.E.M. Siegbahn, and P.-O. Widmark MOLCAS-4 program package 1997 Lund-University Sweden
21. K. Andersson, M. Barysz, A. Bernhardsson, M.R.A. Blomberg, D.L. Cooper, T. Fleig, M.P. Fülscher, C. de Graaf, B.A. Hess, G. Karlström, R. Lindh, P.-Å. Malmqvist, P. Neogrády, J. Olsen, B.O. Roos, A.J. Sadlej, M. Schütz, B. Schimmelpfenning, L. Seijo, L. Serrano-Andrés, P.E.M. Siegbahn, J. Stålring, T. Thorsteinsson, V. Veryazov, and P.-O. Widmark MOLCAS-5 program package 2000 Lund-University Sweden
22. K. Pierloot, B. Dumez, P.-O. Widmark, and B.O. Roos Theor. Chim. Acta 90 1995 87
23. R.P. Amerigo, M. Merchán, I. Nebot-Gil, P.-O. Widmark, and B.O. Roos Theor. Chim. Acta 92 1995 149
24. B.O. Roos, K. Andersson, M.P. Fülscher, P.-Å. Malmquist, L. Serrano-Andres, K. Pierloot, and M. Merchan Adv. Chem. Phys. 93 1996 216
25. B. Schimmelpfennig AMFI, an Atomic Mean-field Integral Program 1996 Stockholm University
26. P.-Å. Malmquist Int. J. Quantum Chem. 30 1986 479
27. P.-Å. Malmquist, and B.O. Roos Chem. Phys. Lett. 155 1989 189
28. J. Olsen, B.O. Roos, and H.J.A. Jensen J. Chem. Phys. 89 1988 2185
29. M. Sjøvoll, O. Gropen, and J. Olsen Theor. Chim. Ac. 87 1997 301
30. S.F. Boys, and F. Bernandi Mol. Phys. 19 1970 553
31. P. Hobza, and R. Zahradnik Chem. Rev. 88 1988 871