In situ experimental evidence for a nonmonotonous structural evolution with composition in the molten LiF-ZrF4 system

Journal of Physical Chemistry B

Volumn 114, Issue 19, 2010, Pages 6472-6479

  Pauvert, Olivier ^a,b   Zanghi, Didier ^a,b   Salarme, Mathieu ^c,d   Simon, Christian ^c   Rakhmatullin, Aydar ^a,b   Matsuura, Haruaki ^a,e,f   Okamoto, Yoshihiro ^g   Vivet, François ^a,b   Bessada, Catherine ^a,b  

^a Centre National de la Recherche Scientifique   (France)

^b UNIVERSITÉ D'ORLÉANS   (France)

^c SORBONNE UNIVERSITÉ   (France)

^d CNRS   (France)

^e Le Studium   (France)

^f TOKYO INSTITUTE OF TECHNOLOGY   (Japan)

^g JAPAN ATOMIC ENERGY AGENCY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

COORDINATION REACTIONS; EXPERIMENTS; FLUORINE COMPOUNDS; MOLECULAR DYNAMICS; NEGATIVE IONS; NUCLEAR MAGNETIC RESONANCE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; RESONANCE; ZIRCONIUM;

ANION COORDINATION; EXAFS; EXPERIMENTAL EVIDENCE; EXTENDED X-RAY ABSORPTION FINE STRUCTURES; FLUORIDE ION; HIGH TEMPERATURE; HIGH-TEMPERATURE NMR; IN-SITU; LOW CONCENTRATIONS; MD SIMULATION; STRUCTURAL EVOLUTION; ZIRCONIUM ION;

ZIRCONIUM COMPOUNDS;

EID: 78650612127     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp912195j     Document Type: Article

References (58)

1. Photiadis, G.; Papatheodorou, G. J. Chem. Soc., Dalton Trans. 1998, 981-989.
2. Photiadis, G.; Papatheodorou, G. J. Chem. Soc., Dalton Trans. 1999, 3541-3548.
3. Hutchinson, F.; Rowley, A.; Walters, M.; Wilson, M.; Madden, P.; Wasse, J.; Salmon, P. J. Chem. Phys. 1999, 111, 2028.
4. Hutchinson, F.; Wilson, M.; Madden, P. Mol. Phys. 2001, 99, 811.
5. Lacassagne, V.; Bessada, C.; Florian, P.; Bouvet, S.; Ollivier, B.; Coutures, J.-P.; Massiot, D. J. Phys. Chem. B 2002, 106, 1862.
6. Watanabe, S.; Adya, A.; Okamoto, Y.; Umesaki, N.; Honma, T.; Deguchi, H.; Horiuchi, M.; Yamamoto, T.; Nogushi, S.; Takase, K.; et al. J. Alloys Compd. 2006, 408-412, 71.
7. Brun, C. L. J. Nucl. Mater. 2007, 360, 1.
8. Vergnes, J.; Lecarpentier, D. Nucl. Eng. Des. 2002, 216, 43.
9. van der Meer, J.; Konings, R. J. Nucl. Mater. 2007, 360, 16.
10. Rosenthal, M.; Haubenreich, P.; McCoy, H.; McNeese, L. At. Energy Rev. 1971, 9, 601.
11. Pherson, H. M. Nucl. Sci. Eng. 1985, 90, 374.
12. Mathieu, L.; Heuer, D.; Brissot, R.; Garzenne, C.; Brun, C. L.; Lecarpentier, D.; Liatard, E.; Loiseaux, J.; Meplan, O.; Merle-Lucotte, E.; et al. Prag. Nucl. Energy 2006, 48, 664.
13. Delpech, S.; Merle-Lucotte, E.; Heuer, D.; Allibert, M.; Ghetta, V.; Le-Brun, C.; Doligez, X.; Picard, G. J. Fluorine Chem. 2009, 130, 11.
14. Toth, L.; Quist, A.; Boyd, G. J. Phys. Chem. 1973, 77, 1384.
15. Dracopoulos, V.; Vagelatos, J.; Papatheodorou, G. J. Chem. Soc., Dalton Trans. 2001, 1117-1122.
16. Hatem, G.; Tabaries, F.; Gaune-Escard, M. Thermochim. Acta 1989, 149, 15.
17. Grande, T.; Aasland, S.; Julsrud, S. J. Am. Ceram. Soc. 1997, 80, 1405.
18. Dugat, P.; El-Ghozzi, M.; Metin, J.; Avignant, D. J. Solid State Chem. 1995, 120, 187.
19. Benes, O.; Konings, R. J. Alloys Compd. 2008, 452, 110.
20. Nuta, I.; Bessada, C.; Veron, E.; Matzen, G. C. R. Chim. 2004, 7, 395.
21. Bessada, C.; Rollet, A.; Rakhmatullin, A.; Nuta, I.; Florian, P.; Massiot, D. C. R. Chim. 2006, 9, 374.
22. Bessada, C.; Rakhmatullin, A.; Rollet, A.; Zanghi, D. J. Nucl. Mater. 2007, 360, 43.
23. Massiot, D.; Fayon, F.; Capron, M.; King, I.; Le Calvé, S.; Alonso, B.; Durand, J.-O.; Bujoli, B.; Gan, Z.; Hoatson, G. Magn. Reson. Chem. 2002, 40, 70.
24. Konishi, H.; Yokoya, A.; Shiwaku, H.; Motohashi, H.; Makita, T.; Kashihara, Y.; Hashimoto, S.; Harami, T.; Sasaki, T.; Maeta, H.; et al. Nucl. Instrum. Methods Phys. Res. A 1996, 372, 322.
25. Michalowicz, A.; Charlier, C. Absorbix: Programme de calcul des coefficients d'absorption, http://www.icmpe.cnrs.fr/spip.php?article578.
26. Rollet, A.; Bessada, C.; Rakhmatullin, A.; Auger, Y.; Melin, P.; Gailhanou, M.; Thiaudiere, D. C. R. Chim. 2004, 7, 1135.
27. Rollet, A.; Rakhmatullin, A.; Bessada, C. Int. J. Thermophys. 2005, 26, 1115.
28. Bessada, C.; Rakhmatullin, A.; Rollet, A.-L.; Zanghi, D. J. Fluorine Chem. 2009, 130, 45.
29. Rollet, A.; Bessada, C.; Auger, Y.; Melin, P.; Gailhanou, M.; Thaudiere, D. Nucl. Instrum. Methods Phys. Res. B 2004, 226, 447.
30. Newville, M. J. Synchrotron Radiat. 2001, 8, 322.
31. Ravel, B.; Newville, M. J. Synchrotron Radiat. 2005, 12, 537.
32. Matsuura, H.; Watanabe, S.; Akatsuka, H.; Okamoto, Y.; Adya, A. J. Fluorine Chem. 2009, 130, 53.
33. Bessada, C.; Rollet, A.-L.; Zanghi, D.; Pauvert, O.; Thefany, C.; Matsuura, H.; Sitaud, B.; Solari, P. Actinide-XAS-2008 p. Publication of the OECD/Nuclear Energy Agency (2009).
34. Madden, P.; Wilson, M. Chem. Soc. Rev. 1996, 25, 339.
35. Salanne, M.; Simon, C.; Turq, P.; Madden, P. J. Phys. Chem. B 2008, 112, 1177.
36. Salanne, M.; Simon, C.; Turq, P.; Madden, P. J. Fluorine Chem. 2009, 130, 38.
37. Salanne, M.; Simon, C.; Groult, H.; Lantelme, F.; Goto, T.; Barhoun, A. J. Fluorine Chem. 2009, 130, 61.
38. Benes, O.; Zeller, P.; Salanne, M.; Konings, R. J. Chem. Phys. 2009, 130, 134716.
39. Aguado, A.; Madden, P. Phys. Rev. B 2004, 70, 245103.
40. Norberg, S.; Ahmed, I.; Hull, S.; Marrocchelli, D.; Madden, P. J. Phys.: Condens. Matter 2009, 21, 215401.
41. Marrocchelli, D.; Madden, P.; Norberg, S.; Hull, S. J. Phys.: Condens. Matter 2009, 21, 405403.
42. Nosé, S. Mol. Phys. 1984, 52, 255.
43. Martyna, G.; Klein, M.; Tuckerman, M. J. Chem. Phys. 1992, 97, 2635.
44. Ankudinov, A.; Ravel, B.; Rehr, J.; Conradson, S. Phys. Rev. B 1998, 58, 007565.
45. Kellõ, V.; Pyykkõ, P.; Sadlej, A.; Schwerdtfeger, P.; Thyssen, J. Chem. Phys. Lett. 2000, 318, 111.
46. Bastow, T.; Smith, M.; Stuart, S. Chem. Phys. Lett. 1992, 191, 125.
47. Pauvert, O.; Fayon, F.; Rakhmatullin, A.; Krämer, S.; Horvatić, M.; Avignant, D.; Berthier, C.; Deschamps, M.; Massiot, D.; Bessada, C. Inorg. Chem. 2009, 48, 8709.
48. Filipponi, A. J. Phys.: Condens. Matter 2001, 13, R23.
49. Ferlat, G.; Soetens, J.; Miguel, A. S.; Bopp, P. J. Phys.: Condens. Matter 2005, 17, S145.
50. Ferlat, G.; Cormier, L.; Thibault, M.; Galoisy, L.; Calas, G.; Delaye, J.; Ghaleb, D. Phys. Rev. B 2006, 73, 214207.
51. Okamoto, Y. Nucl. Instrum. Methods Phys. Res. A 2004, 526, 572.
52. Okamoto, Y.; Suzuki, S.; Shiwaku, H.; Ikeda-Ohno, A.; Yaita, T.; Madden, P. J. Phys. Chem. A 2010, 114, 4664.
53. Watanabe, S.; Matsuura, H.; Akatsuka, H.; Okamoto, Y.; Madden, P. J. Nucl. Mater. 2005, 344, 104.
54. Wilmshurst, J. J. Chem. Phys. 1963, 39, 2545.
55. Torres-Lapasio, J.; Baeza-Baeza, J.; Garcia-Alvarez-Coque, M. Anal. Chem. 1997, 69, 3822.
56. Legein, C.; Fayon, F.; Martineau, C.; Body, M.; Buzare, J.-Y.; Massiot, D.; Durand, E.; Tressaud, A.; Demourgues, A.; Peron, O.; et al. Inorg. Chem. 2006, 45, 10636.
57. Romero-Serrano, A.; Hallen-Lopez, M.; Zeifert, B.; Gomez-Yanez, C; Hernandez-Ramirez, A. J. Fluorine Chem. 2009, 130, 336.
58. Benes, O.; Konings, R. J. Fluorine Chem. 2009, 130, 22.