Potassium zinc borohydrides containing triangular [Zn(BH 4) 3] - and tetrahedral [Zn(BH 4) xCl 4-x] 2- anions

Journal of Physical Chemistry C

Volumn 116, Issue 1, 2012, Pages 1563-1571

  Černý, Radovan ^a   Ravnsbæk, Dorthe B ^b   Schouwink, Pascal ^a   Filinchuk, Yaroslav ^c   Penin, Nicolas ^a,d   Teyssier, Jeremie ^a   Smrčok, L'Ubomír ^e   Jensen, Torben R ^b  

^a UNIVERSITY OF GENEVA   (Switzerland)

^b AARHUS UNIVERSITY   (Denmark)

^c UNIVERSITÉ CATHOLIQUE DE LOUVAIN   (Belgium)

^d CNRS   (France)

^e INSTITUTE OF CHEMISTRY   (Slovakia)

Author keywords

[No Author keywords available]

Indexed keywords

ANIONIC COMPLEX; BALL-MILLED; BOROHYDRIDES; DECOMPOSITION TEMPERATURE; DIBORANE; IN-SITU SYNCHROTRONS; MILLING TIME; MOLAR RATIO; MONOCLINIC DISTORTION; PARAELECTRICS; SOLID-STATE DFT CALCULATIONS; SPACE GROUPS; STRUCTURE TRANSFORMS; STRUCTURE TYPE; TETRAHEDRAL COMPLEXES; TRIGONAL PRISMS;

CESIUM; CHLORINE COMPOUNDS; DENSITY FUNCTIONAL THEORY; HYDROGEN; NEGATIVE IONS; POTASSIUM; RAMAN SPECTROSCOPY; SODIUM; THERMOANALYSIS;

ZINC;

EID: 84855904867     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp209848r     Document Type: Article

References (61)

1. Nakamori, Y. and Orimo, S. In Solid-State Hydrogen Storage, Materials and chemistry; Walker, G., Ed.; Woodhead Publishing Ltd., 2008; pp 420-449.
2. Ravnsbæk, D. B.; Filinchuk, Y.; Černý, R.; Jensen, T. R. Z. Kristallogr. 2010, 225, 557-569
3. Li, H.-W.; Orimo, S.; Nakamori, Y.; Miwa, K.; Ohba, N.; Towata, S.; Züttel, A. J. Alloys Compd. 2007, 446-447, 315-318
4. Hagemann, H.; Černý, R. Dalton Trans. 2010, 39, 6006-6012
5. Schlesinger, H. I.; Burg, A. B. Chem. Rev. 1942, 31, 1-41
6. Semenko, K. N.; Kravchenko, O. V.; Polyakova, V. B. Russ. Chem. Rev. 1973, 42, 1-13
7. Nöth, H. Angew. Chem. 1961, 73, 371-383
8. Marks, T. J.; Kolb, J. R. Chem. Rev. 1977, 77, 263-293
9. James, B. D.; Wallbridge, M. G. H. Prog. Inorg. Chem. 1970, 11, 99-231
10. Hagemann, H.; Longhini, M.; Kaminski, J. W.; Wesolowski, T. A.; Černý, R.; Penin, N.; Sorby, M. H.; Hauback, B. C.; Severa, G.; Jensen, C. M. J. Phys. Chem. A 2008, 112, 7551-7555
11. Černý, R.; Severa, G.; Ravnsbæk, D.; Filinchuk, Y.; D'Anna, V.; Hagemann, H.; Haase, D.; Jensen, C. M.; Jensen, T. R. J. Phys. Chem. C 2010, 114, 1357-1364
12. Černý, R.; Ravnsbæk, D.; Severa, G.; Filinchuk, Y.; D'Anna, V.; Hagemann, H.; Haase, D.; Skibsted, J.; Jensen, C. M.; Jensen, T. R. J. Phys. Chem. C 2010, 114, 19540-19549
13. Ravnsbæk, D.; Filinchuk, Y.; Cerenius, Y.; Jakobsen, H. J.; Besenbacher, F.; Skibsted, J.; Jensen, T. R. Angew. Chem., Int. Ed. 2009, 48, 6659-6663
14. Černý, R.; Ki Chul Kim; Penin, N.; D'Anna, V.; Hagemann, H.; Sholl, D. S. J. Phys. Chem. C 2010, 114, 19127-19133
15. Lindemann, I.; Domènech Ferrer, R.; Dunsch, L.; Filinchuk, Y.; Černý, R.; Hagemann, H.; D'Anna, V.; Lawson Daku, L. M.; Schultz, L.; Gutfleisch, O. Chem.-Eur. J. 2010, 16, 8707-8712
16. Lindemann, I.; Domènech Ferrer, R.; Dunsch, L.; Černý, R.; Hagemann, H.; D'Anna, V.; Filinchuk, Y.; Schultz, L.; Gutfleisch, O. Faraday Discuss. 2011, 151, 231-242
17. Ravnsbæk, D.; Sørensen, L. H.; Filinchuk, Y.; Reed, D; Book, D; Cerenius, Y.; Jakobsen, H. J.; Besenbacher, F.; Skibsted, J.; Jensen, T. R. Eur. J. Inorg. Chem. 2010, 1608-1612
18. Ravnsbæk, D. B.; Ley, M. B.; Lee, Y.-S.; Hagemann, H.; D'Anna, V.; Cho, Y. W.; Filinchuk, Y.; Jensen, T. R. (2011, submitted.
19. Mosegaard, L.; Møller, B.; Jørgensen, J.-E.; Filinchuk, Y.; Cerenius, Y.; Hanson, J.; Dimasi, E.; Besenbacher, F.; Jensen, T. J. Phys. Chem. C 2008, 112, 1299-1303
20. Arnbjerg, L. M.; Ravnsbæk, D. B.; Filinchuk, Y.; Vang, R. T.; Cerenius, Y.; Besenbacher, F.; Jørgensen, J.-E.; Jakobsen, H. J.; Jensen, T. R. Chem. Mater. 2009, 21, 5772-5782
21. Černý, R.; Penin, N.; D'Anna, V.; Hagemann, H.; Durand, E.; Ruzicka, J. Acta Mater. 2011, 59, 5171-5180
22. Lee, J. Y.; Ravnsbæk, D.; Lee, J. S.; Kim, Y.; Cerenius, Y.; Shim, J.-S.; Jensen, T. R.; Hur, N. W.; Cho, Y. W. J. Phys. Chem. C 2009, 113, 15080-15086
23. Hagemann, H.; D'Anna, V.; Rapin, J. P.; Černý, R.; Filinchuk, Ya.; Ki Chul Kim Sholl, D. S.; Parker, S. F. J. Alloys Compd. 2011, 509, S688-S690
24. Bardají, E. G.; Zhao-Karger, Z.; Boucharat, N.; Nale, A.; van Setten, M. J.; Lohstroh, W.; Röhm, E.; Catti, M.; Fichtner, M. J. Phys. Chem. C 2011, 115, 6095-6101
25. Hagenmuller, P.; Rault, M. C. R. Acad. Sci. 1959, 248, 2758-2760
26. Mikheeva, V. I.; Mal'tseva, N. N.; Alekseeva, L. S. Russ. J. Inorg. Chem. 1968, 13, 682-685
27. Schouwink, P.; D'Anna, V.; Ley, M. B.; Lawson Daku, L. M.; Jensen, T. R.; Hagemann, H.; Černý, R., submitted.
28. Ravnsbæk, D. B.; Sørensen, L. H.; Filinchuk, Y.; Besenbacher, F.; Jensen, T. R. (2011, submitted.
29. Hammersley, A. P.; Svensson, S. O.; Hanfland, M.; Fitch, A. N.; Häusermann, D. High Pressure Res. 1996, 14, 235-248
30. Quilinchini, M.; Bernede, P.; Lefebvre, J.; Schweiss, P. J. Phys.: Condens. Matter 1990, 2, 4543-4558
31. Favre-Nicolin, V.; Černý, R. J. Appl. Crystallogr. 2002, 35, 734-743
32. Menary, J. W. Acta Crystallogr. 1955, 8, 840
33. Coelho, A. A. TOPAS-Academic; http://members.optusnet.com.au/~alancoelho.
34. Villars, P.; Cenzual, K. Pearson's Crystal Data, Release 2010/2011; ASM International, Materials Park, Ohio, USA, 2011.
35. Spek, A. L. PLATON; University of Utrecht: The Netherlands, 2006.
36. Efron, B.; Tibshirani, R. Stat. Sci. 1986, 1, 54-77
37. Kresse, G.; Hafner, J. Phys. Rev. B 1993, 48, 13115-13118
38. Kresse, G.; Furthmüller J. Phys. Rev. B 1996, 54, 11169-11186
39. Kresse, G.; Furthmüller Comput. Mater. Sci. 1996, 6, 15-50
40. Perdew, J. P.; Wang, Y. Phys. Rev. B 1992, 45, 13244-13249
41. Blöchl, P. E. Phys. Rev. B 1994, 50, 17953-17979
42. Kresse, G.; Joubert, J. Phys. Rev. B 1999, 59, 1758-1775
43. Kresse, G.; Hafner, J. J. Phys.: Condens. Matter 1994, 6, 8245-8527
44. Teter, M. P.; Payne, M. C.; Allan, D. C. Phys. Rev. B 1989, 40, 12255-12263
45. Bylander, D. M.; Kleinman, L.; Lee, S. Phys. Rev. B 1990, 42, 1394-1403
46. Hafner, J. J. Mol. Struct. 2003, 651-653, 3-17
47. Portmann, S.; Luthi, H. P. Chimia 2000, 54, 766-769
48. Powell, H. M.; Wells, A. F. J. Chem. Soc. 1935, 359-362
49. Al-Kahtani, A.; Williams, D. L.; Nibler, J. W.; Sharpe, S. W. J. Phys. Chem. A 1998, 102, 537-544
50. Filinchuk, Y.; Chernyshov, D.; Dmitriev, V. Z. Kristallogr. 2008, 223, 649-659
51. Filinchuk, Y.; Chernyshov, D.; Dmitriev, V. In Boron hydrides, high potential hydrogen storage materials; Demirci, U.B.;; Miele, P., Eds.; Nova Publishers, 2010a; arXiv: abs/1003.5378.
52. Ravnsbæk, D.; Frommen, C.; Reed, D; Filinchuk, Y.; Sørby, M.; Hauback, H. J.; Jakobsen, D.; Book, D; Besenbacher, F.; Skibsted, J.; Jensen, T. R. J. Alloys Compd. 2011, 509S, 5698-5704
53. Abrikosov, N. K.; Wasserman, A. M.; Poretskaya, L. V. Dokl. Akad. Nauk SSSR 1958, 123, 279-281 (in Russian).
54. Edshammar, L. E., Dissertation, University of Stockholm, 1969.
55. Makarov, E. S. Izv. Akad. Nauk SSSR (Ser. Khim.) 1944, 29
56. Laves, F.; Wallbaum, H. J. Z. Angew. Mineral. 1942, 4, 17-46
57. Stöwe, K. Z. Kristallogr. 2004, 219, 359-369
58. Kovaleva, I. S.; Kuznetsova, I. Y.; Fedorov, V. A.; Boguslavskii, A. A.; Lotfullin, R. S. Russ. J. Inorg. Chem. 1990, 35, 100-103
59. Avery, J. S.; Burbridge, C. D.; Goodgame, D. M. L. Spectrochim. Acta A 1968, 24, 1721-1726
60. Jeon, E.; Cho, Y. W. J. Alloys Compd. 2006, 422, 273-275
61. Brandenburg, K. DIAMOND, version 3.2.g; Crystal Impact GbR: Bonn, Germany, 2011.