7Li NMR knight shifts in Li-Sn compounds: MAS NMR measurements and correlation with DFT calculations

Journal of Physical Chemistry C

Volumn 114, Issue 14, 2010, Pages 6749-6754

  Bekaert, Emilie ^a   Robert, Florent ^b   Lippens, Pierre Emmanuel ^b   Ménétrier, Michel ^a  

^a UNIVERSITÉ DE BORDEAUX   (France)

^b UNIVERSITÉ DE MONTPELLIER   (France)

Author keywords

[No Author keywords available]

Indexed keywords

BALL MILLING; BINARY ALLOYS; CALCULATIONS; ELECTRONIC STRUCTURE; LITHIUM COMPOUNDS; NUCLEAR MAGNETIC RESONANCE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; SILICA; TIN COMPOUNDS;

CRYSTALLINE PHASIS; DENSITY OF STATE; DFT CALCULATION; ELECTRONIC STRUCTURE CALCULATIONS; FIELD PENETRATION; FIRST PRINCIPLES METHOD; GOOD CORRELATIONS; WEIGHTED AVERAGES;

TIN ALLOYS;

EID: 77951063420     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp100365u     Document Type: Article

References (40)

1. Nagaura, T.; Tazawa, K. Prog. Batteries Sol. Cells 1990, 9, 209
2. Disma, F.; Aymard, L.; Dupont, L.; Tarascon, J.-M. J. Electrochem. Soc. 1996, 143, 3959-3972
3. Salver-Disma, F.; Lenain, C.; Beaudoin, B.; Aymard, L.; Tarascon, J. M. Solid State Ionics 1997, 98, 145-158
4. Yang, J.; Takeda, Y.; Imanishi, N.; Ichikawa, T.; Yamamoto, O. Solid State Ionics 2000, 135, 175-180
5. Besenhard, J. O.; Yang, J.; Winter, M. J. Power Sources 1997, 68, 87-90
6. Wen, C. J.; Huggins, R. A. J. Electrochem. Soc. 1981, 128, 1181-1187
7. Dahn, J. R.; Courtney, I. A.; Mao, O. Solid State Ionics 1998, 111, 289-294
8. Courtney, I. A.; Dahn, J. R. J. Electrochem. Soc. 1997, 144, 2045-2052
9. Whitehead, A. H.; Elliott, J. M.; Owen, J. R. J. Power Sources 1999, 81-82, 33-38
10. Yu, A.; Frech, R. J. Power Sources 2002, 104, 97-100
11. Nuli, Y.-N.; Zhao, S.-L.; Qin, Q.-Z. J. Power Sources 2003, 114, 113-120
12. Yoshio, I.; Kubota, T.; Matsufuji, A.; Maekawa, Y.; Miyasaka, T. Science 1997, 276, 1395-1397
13. Fuji Photo Film Co. Ltd., European Patent, EP 0704 921 A1, 1995.
14. Tanizaki, H.; Miyagi, O.; Fukushima, A. U.S. patent 0053131, 2004.
15. Aboulaich, A.; Mouyane, M.; Robert, F.; Lippens, P. E.; Olivier-Fourcade, J.; Willmann, P.; Jumas, J. C. J. Power Sources 2007, 174, 1224-1228
16. Kepler, K. D.; Vaughey, J. T.; Thackeray, M. M. Electrochem. Solid-State Lett. 1999, 2, 307-309
17. Ionica-Bousquet, C. M.; Lippens, P. E.; Aldon, L.; Olivier-Fourcade, J.; Jumas, J. C. Chem. Mater. 2006, 18, 6442-6447
18. Naille, S.; Ionica-Bousquet, C. M.; Robert, F.; Morato, F.; Lippens, P. E.; Olivier-Fourcade, J. J. Power Sources 2007, 174, 1091-1094
19. Ehinon, K. K. D.; Naille, S.; Dedryvère, R.; Lippens, P. E.; Jumas, J. C.; Gonbeau, D. Chem. Mater. 2008, 20, 5388-5398
20. Robert, F.; Lippens, P. E.; Olivier-Fourcade, J.; Jumas, J. C.; Gillot, F.; Morcrette, M.; Tarascon, J. M. J. Solid State Chem. 2007, 180, 339-348
21. Furuya, K.; Ogawa, K.; Mineo, Y.; Matsufuji, A.; Okuda, J.; Erata, T. J. Phys.: Condens. Matter 2001, 13, 3519-3532
22. Goward, G. R.; Leroux, F.; Power, W. P.; Ouvrard, G.; Dmowski, W.; Egami, T.; Nazar, L. F. Electrochem. Solid-State Lett. 1999, 2, 367-370
23. Wang, Y.; Sakamoto, J.; Huang, C. K.; Surampudi, S.; Greenbaum, S. G. Solid State Ionics 1998, 110, 167-172
24. Hansen, D. A.; Chang, L. J. Acta Crystallogr., Sect. B: Struct. Sci. 1969, 25, 2392-2395
25. Müller, W.; Schäfer, H. Z. Naturforsch., B: J. Chem. Sci. 1973, 28b, 246-248
26. Müller, W. Z. Naturforsch., B: J. Chem. Sci. 1974, 29b, 304
27. Frank, U.; Müller, W.; Schäfer, H. Z. Naturforsch., B: J. Chem. Sci. 1975, 30b, 1
28. Frank, U.; Müller, W. Z. Naturforsch., B: J. Chem. Sci. 1975, 30b, 316
29. Frank, U.; Müller, W.; Schäfer, H. Z. Naturforsch., B: J. Chem. Sci. 1975, 30b, 6
30. Gladyshevski, E. I.; Oleksiv, G. I.; Kripyakevich, P. I. Kristallografiya 1964, 9, 338
31. Gladyshevski, E. I.; Oleksiv, G. I.; Kripyakevich, P. I. Sov. Phys. Crystallogr. 1964, 9, 269
32. Gaffet, E.; Bernard, F.; Niepce, J.-C.; Charlot, F.; Gras, C.; Caër, G. L.; Guichard, J.-L.; Delcroix, P.; Mocellin, A.; Tillement, O. J. Mater. Chem. 1999, 9, 305
33. Massiot, D.; Fayon, F.; Capron, M.; King, I.; Le Calve, S.; Alonso, B.; Durand, J. O.; Bujoli, B.; Gan, Z. H.; Hoatson, G. Magn. Reson. Chem. 2002, 40, 70-76
34. Blaha, P.; Schwarz, K.; Luitz, J. WIEN97, Vienna University of Technology, 1997 improved and updated Unix version of the original copyright WIEN code (Blaha, P.; Schwarz, K.; Sorantin, P.; Trickey, S. B. Comput. Phys. Commun. 1990, 59, 399-415).
35. Kohn, W.; Sham, L. J. Phys. Rev. B 1965, 140, A1133 P
36. Hohenberg; Kohn, W. Phys. Rev. B 1964, 136, B864
37. Perdew, J. P.; Burke, K.; Ernzerhof, M. Phys. Rev. Lett. 1996, 77, 3865
38. Wu, Z.; Eckert, H.; Senker, J.; Johrendt, D.; Kotzyba, G.; Mosel, B. D.; Trill, H.; Hoffmann, R.-D.; Pottgen, R. J. Phys. Chem. B 2003, 107, 1943-1948
39. Goward, G. R.; Taylor, N. J.; Souza, D. C. S.; Nazar, L. F. J. Alloys Compd. 2001, 329, 82-91
40. d'Avezac, M.; Marzari, N.; Mauri, F. Phys. Rev. B 2007, 76, 165122