Molecular dynamics to rationalize EXAFS experiments: A dynamical model explaining hydration behaviour across the lanthanoid(III) series

Journal of Physics: Conference Series

Volumn 190, Issue , 2009, Pages

  Spezia, Riccardo ^a   Duvail, Magali ^a   Vitorge, Pierre ^a,b   D'Angelo, Paola ^c  

^a UNIVERSITÉ D EVRY VAL D ESSONNE   (France)

^b CEA SACLAY   (France)

^c SAPIENZA UNIVERSITY OF ROME   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 73349140194     PISSN: 17426588     EISSN: 17426596     Source Type: Conference Proceeding    
DOI: 10.1088/1742-6596/190/1/012056     Document Type: Conference Paper

References (31)

1. D'Angelo P, Barone V, Chillemi G, Sanna N, Mayer-Klaucke W and Pavel N V 2002 J. Am. Chem. Soc. 124 1958-1967
2. Chillemi G, D'Angelo P, Pavel N V, Sanna N and Barone V 2002 J. Am. Chem. Soc. 124 1968-1976
3. Spezia R, Duvail M, Vitorge P, Cartailler T, Tortajada J, D'Angelo P and Gaigeot M-P 2006 J. Phys. Chem. A 110 13081-13088
4. D'Angelo P, Migliorati V, Mancini G, Barone V and Chillemi G 2008 J. Chem. Phys. 128 84502
5. Habenschuss A and Spedding F H 1979 J. Chem. Phys. 70 2797-2806
6. Habenschuss A and Spedding F H 1979 J. Chem. Phys. 70 3758-3763
7. Choppin G R and Strazik W F 1965 Inorg. Chem. 4 1250-1254
8. Choppin G R and Graffeo A J 1965 Inorg. Chem. 4 1254-1257
9. Bertha S L and Choppin G R 1969 Inorg. Chem. 8 613-617
10. Helm L and Merbach A E 2005 Chem. Rev. 105 1923-1960
11. Persson I, D'Angelo P, De Panfilis S, Sandstrom M and Eriksson L 2008 Chem. Eur. J. 14 3056-3066
12. Duvail M, Spezia R and Vitorge P 2008 ChemPhysChem. 9 693-696
13. Duvail M, Vitorge P and Spezia R 2009 J. Chem. Phys. 130 104501
14. Villa A, Hess B and Saint-Martin H 2009 J. Phys. Chem. B 113 7270-7281
15. Duvail M, Souaille M, Spezia R, Cartailler T and Vitorge P 2007 J. Chem. Phys. 127 034503
16. Duvail M, D'Angelo P, Gaigeot M-P, Vitorge P and Spezia R 2009 Radiochim. Acta 97 339-346
17. Kowall T, Foglia F, Helm L and Merbach A E 1995 J. Phys. Chem. 99 13078-13087
18. Kowall T, Foglia F, Helm L and Merbach A E 1995 J. Am. Chem. Soc. 117 3790-3799
19. Floris F M and Tani A 2001 J. Chem. Phys. 115 4750-4765
20. Ikeda T, Hirata M and Kimura T 2005 J. Chem. Phys. 122 244507
21. Yazyev O V and Helm L 2007 J. Chem. Phys. 127 084506
22. Hofer T S, Scharnagl H, Randolf B R and Rode B M 2006 Chem. Phys. 327 31-42
23. Duvail M, Spezia R, Cartailler T and Vitorge P 2007 Chem. Phys. Lett. 448 (1-3) 41-45
24. Ishiguro S I, Umebayashi Y, Kato K, Takahashib R and Ozutsumi K 1998 J. Chem. Soc. Faraday Trans. 94 3607-3612
25. Ishiguro S I, Umebayashi Y and Komiya M 2002 Coord. Chem. Rev 226 103-111
26. Filipponi A, Borowski M, Bowron D T, Ansell S, De Panfilis S, Di Cicco A and Itiè J-P 2000 Rev. Sci. Instrum. 71 2422-2432
27. Filipponi A, D'Angelo P, Pavel N V and Di Cicco A 1994 Chem. Phys. Lett. 225 150-155
28. Filipponi A, Di Cicco A and Natoli C R 1995 Phys. Rev. B 52 15122
29. Burattini E, D'Angelo P, Giglio E and Pavel N V 1991 J. Phys. Chem. 95 7880-7885
30. D'Angelo P, De Panfilis S, Filipponi A and Persson I 2008 Chem.-Eur. J. 14 3045-3055
31. D'Angelo P personal communication