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Volumn 8, Issue 6, 2002, Pages 1361-1371

Photodissociation and electronic spectroscopy of [Re(H)(CO)3(H-dab)] (H-dab = 1,4-diaza-1,3-butadiene): Quantum wavepacket dynamics based on Ab initio potentials

(2) Bruand Cote, Isabelle a Daniel, Chantal a

a UNIVERSITÉ DE STRASBOURG (France)

Author keywords

Ab initio calculations; Dynamics; Organometallics; Photochemistry; Quantum chemistry; Rhenium

Indexed keywords

ABSORPTION; CHARGE TRANSFER; CHEMICAL BONDS; COMPUTER SIMULATION; ELECTRON SPECTROSCOPY; GROUND STATE; PHOTODISSOCIATION; ULTRAVIOLET RADIATION;

QUANTUM WAVEPACKET DYNAMICS;

RHENIUM COMPOUNDS;

1,3 BUTADIENE DERIVATIVE; 1,4 DIAZA 1,3 BUTADIENE; LIGAND; MANGANESE; METAL; RHENIUM; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ABSORPTION SPECTROSCOPY; ARTICLE; CHEMICAL BINDING; DISSOCIATION; EXCITATION; MOLECULAR DYNAMICS; QUANTUM MECHANICS; ROTATION; SPECTROSCOPY;

EID: 0037087711 PISSN: 09476539 EISSN: None Source Type: Journal
DOI: 10.1002/1521-3765(20020315)8:6<1361::AID-CHEM1361>3.0.CO;2-E Document Type: Article

Times cited : (21)

References (43)

1
- 0000327103
- (1992) Comments Inorg. Chem. , vol.13 , pp. 359
- Stufkens, D.J.¹

2
- 0011816496
- (1998) Coord. Chem. Rev. , vol.177 , pp. 127
- Stufkens, D.J.¹ Vlček Jr., A.²

3
- 0032045201
- (1998) Coord. Chem. Rev. , vol.171 , pp. 93
- Stufkens, D.J.¹ Aarnts, M.P.² Nijhoff, J.³ Rossenaar, B.D.⁴ Vlček Jr., A.⁵

4
- 0000934390
- (1994) Coord. Chem. Rev. , vol.132 , pp. 147
- Stufkens, D.J.¹ Van Outerstep, J.M.W.² Oskam, A.³ Rossenaar, B.D.⁴ Stor, G.J.⁵

5
- 6744261795
- (1994) J. Chem. Soc. Chem. Commun. , pp. 63
- Rossenaar, B.D.¹ Kleverlaan, C.J.² Stufkens, D.J.³ Oskam, A.⁴

6
- 0000147436
- (1996) Inorg. Chim. Acta , vol.247 , pp. 215
- Rossenaar, B.D.¹ Stufkens, D.J.² Oskam, A.³ Fraanje, J.⁴ Goubitz, K.⁵

7
- 0000638813
- (1996) Chem. Eur. J. , vol.2 , pp. 228
- Rossenaar, B.D.¹ Kleverlaan, C.J.² Van de Ven, M.C.E.³ Stufkens, D.J.⁴ Vlček Jr., A.⁵

8
- 0001613088
- (1993) Inorg. Chim. Acta , vol.208 , pp. 103
- Lucia, L.A.¹ Burton, R.D.² Schanze, K.S.³

9
- 0001040182
- (1996) Phys. Chem. , vol.100 , pp. 18607
- Kleverlaan, C.J.¹ Martino, D.M.² Van Willigen, H.³ Stufkens, D.J.⁴ Oskam, A.J.⁵

10
- 0034646761
- (2000) Chem. Eur. J. , vol.6 , pp. 1386
- Farrell, I.R.¹ Matousek, P.² Kleverlaan, C.J.³ Vlček Jr., A.⁴

11
- 0033810522
- (2000) Coord. Chem. Rev. , vol.208 , pp. 87
- Farrell, I.R.¹ Vlček Jr., A.²

12
- 0008685670
- (1995) J. Chem. Soc. Chem. Commun. , pp. 63
- Finger, K.¹ Daniel, C.²

13
- 0000832871
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 12322
- Finger, K.¹ Daniel, C.²

14
- 0347759009
- (1998) Coord. Chem. Rev. , vol.171 , pp. 439
- Guillaumont, D.¹ Finger, K.² Hachey, M.R.D.³ Daniel, C.⁴

15
- 0008685527
- (1998) Coord. Chem. Rev. , vol.181 , pp. 177
- Guillaumont, D.¹ Daniel, C.²

16
- 0000017244
- (1998) Inorg. Chem. , vol.37 , pp. 5816
- Guillaumont, D.¹ Wilms, M.P.² Daniel, C.³ Stufkens, D.J.⁴

17
- 0001427398
- (1996) Chem. Eur. J. , vol.2 , pp. 1556
- Aarnts, M.P.¹ Stufkens, D.J.² Wilms, M.P.³ Baerends, E.J.⁴ Vlček Jr., A.⁵ Clark, I.P.⁶ George, M.W.⁷ Turner, J.J.⁸

18
- 0001303258
- (1996) Inorg. Chem. , vol.35 , pp. 5468
- Aarnts, M.P.¹ Wilms, M.P.² Peleen, K.³ Fraanje, J.⁴ Goubitz, K.⁵ Hartl, F.⁶ Stufkens, D.J.⁷ Baerends, E.J.⁸ Vlček Jr., A.⁹

19
- 0001429059
- (1997) Organometallics , vol.16 , pp. 2055
- Aarnts, M.P.¹ Wilms, M.P.² Stufkens, D.J.³ Baerends, E.J.⁴ Vlček Jr., A.⁵

20
- 0033596305
- (1999) J. Am. Chem. Soc. , vol.121 , pp. 11733
- Guillaumont, D.¹ Daniel, C.²

21
- 0000991286
- (1995) J. Organomet. Chem. , vol.493 , pp. 153
- Rossenaar, B.D.¹ Kleverlaan, C.J.² Van de Ven, M.C.E.³ Stufkens, D.J.⁴ Oskam, A.⁵ Fraanje, J.⁶ Goubitz, K.⁷

22
- 2942520201
- (1993) J. Chem. Phys. , vol.99 , pp. 6465
- Kukolich, S.G.¹ Sickafoose, S.M.²

23
- 0000522231
- (1998) Inorg. Chem. , vol.37 , pp. 1387
- Hachey, M.R.J.¹ Daniel, C.²

24
- 0030880497
- (1997) J. Am. Chem. Soc. , vol.119 , pp. 8269
- Heitz, M.C.¹ Daniel, C.²

25
- 11744322674
- (1990) Theor. Chim. Acta , vol.77 , pp. 123
- Andrae, D.¹ Haeussermann, U.² Dolg, M.³ Stoll, H.⁴ Preuss, H.⁵

26
- 84944675147
- (1993) Mol. Phys. , vol.80 , pp. 1431
- Bergner, A.¹ Dolg, M.² Kuechle, W.³ Stoll, H.⁴ Preuss, H.⁵

27
- 36849140788
- (1965) Chem. Phys. , vol.42 , pp. 1293
- Huzinaga, S.J.¹

28
- 0004094224
- University of Lund (Sweden)
- (1998) MOLCAS 4.1
- Andersson, K.¹ Blomberg, M.R.A.² Fülscher, M.P.³ Karlström, G.⁴ Lindh, R.⁵ Malmqvist, P.-Å.⁶ Neagrady, P.⁷ Olsen, J.⁸ Roos, B.O.⁹ Sadlej, A.J.¹⁰ Schütz, M.¹¹ Seijo, L.¹² Serrano-Andrés, L.¹³ Siegbahn, P.E.M.¹⁴ Widmark, P.-O.¹⁵

29
- 36449008085
- (1994) J. Chem. Phys. , vol.100 , pp. 6591
- Ribbing, C.¹ Daniel, C.²

30
- 33748487821
- (1996) J. Phys. Chem. , vol.100 , pp. 3368
- Finger, K.¹ Daniel, C.² Saalfrank, P.³ Schmidt, B.⁴

31
- 0000189651
- (1993) J. Chem. Phys. , vol.98 , pp. 5648
- Becke, A.D.¹

32
- 0001869945
- (Ed.: H. F. Schaefer, III), Plenum, NY
- (1976) Modern Theoretical Chemistry , vol.3 , pp. 1
- Dunning Jr., T.H.¹ Hay, P.J.²

33
- 27344448074
- (1985) J. Chem. Phys. , vol.82 , pp. 299
- Hay, P.J.¹ Wadt, W.R.²

35
- 0008699985
- (1989) Chem. Phys. , vol.139 , pp. 123
- Hartke, B.¹ Manz, J.² Mathis, J.³

36
- 0008690629
- (1989) Chem. Phys. , vol.139 , pp. 323
- Joseph, T.¹ Kruel, T.M.² Manz, J.³ Rexrodt, I.⁴

37
- 26844506572
- (1989) J. Chem. Phys. , vol.91 , pp. 3571
- Marston, C.C.¹ Balint-Kurti, G.G.²

38
- 0242510121
- (1984) J. Chem. Phys. , vol.81 , pp. 3967
- Tal-Ezer, H.¹ Kosloff, R.²

39
- 0000366437
- (1995) Chem. Phys. Lett. , vol.239 , pp. 230
- Katz, G.¹ Baer, R.² Kosloff, R.³

40
- 0001107547
- (1999) J. Phys. Chem. A , vol.103 , pp. 5766
- Daniel, C.¹ Guillaumont, D.² Ribbing, C.³ Minaev, B.⁴

41
- 0003960956
- (Ed.: A. Dedieu), VCH, New York
- (1991) Transition Metal Hydrides , pp. 309-359
- Kristjansdottir, S.S.¹ Norton, J.R.²

42
- 0000767675
- and references therein
- (1995) Organometallics , vol.14 , pp. 423
- Ehlers, W.A.¹ Frenking, G.²

43
- 0008686628
- unpublished results
- Bruand-Cote, I.¹ Guillaumont, D.² Daniel, C.³

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