High-pressure synthesis and characterization of the alkaline earth borate β-BaB4O7

Solid State Sciences

Volumn 11, Issue 2, 2009, Pages 336-342

  Knyrim, Johanna S ^a   Römer, S Rebecca ^a   Schnick, Wolfgang ^a   Huppertz, Hubert ^b  

^a UNIVERSITY OF MUNICH   (Germany)

^b UNIVERSITY OF INNSBRUCK   (Austria)

Author keywords

Borate; Chemical twinning; Crystal structure; Density functional theory; High pressure phase

Indexed keywords

ALKALINE EARTH METALS; BARIUM; BINARY MIXTURES; CALCIUM; DENSITY FUNCTIONAL THEORY; EUROPIUM; LEAD; MERCURY (METAL); PROGRAMMING THEORY; SYNTHESIS (CHEMICAL); TIN;

ALKALINE EARTHS; BARIUM BORATES; BINARY OXIDES; BORATE; CHEMICAL TWINNING; DENSITY-FUNCTIONAL CALCULATIONS; HIGH-PRESSURE PHASE; HIGH-PRESSURE PHASIS; HIGH-PRESSURE SYNTHESIS; LATTICE PARAMETERS; MULTI-ANVIL APPARATUS; NETWORK STRUCTURES; PRESSURE PHASE; PRESSURE PHASIS; SPACE GROUPS; STOICHIOMETRIC MIXTURES; STRUCTURAL DIFFERENCES; TEMPERATURE CONDITIONS; TRANSITION PRESSURES;

CRYSTAL STRUCTURE;

EID: 58949094526     PISSN: 12932558     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.solidstatesciences.2008.07.015     Document Type: Article

References (75)

1. Knyrim J.S., Friedrichs J., Neumair S., Roeßner F., Floredo Y., Jakob S., Johrendt D., Glaum R., and Huppertz H. Solid State Sci. 10 (2008) 168
2. Huppertz H., and Heymann G. Solid State Sci. 5 (2003) 281
3. Huppertz H. Z. Naturforsch. B58 (2003) 257
4. Emme H., Weil M., and Huppertz H. Z. Naturforsch. B60 (2005) 815
5. Heymann G., Soltner T., and Huppertz H. Solid State Sci. 8 (2006) 821
6. Haberer A., Heymann G., and Huppertz H. Z. Naturforsch. B62 (2007) 759
7. Knyrim J.S., Becker P., Johrendt D., and Huppertz H. Angew. Chem. 118 (2006) 8419
8. Angew. Chem. Int. Ed. 45 (2006) 8239
9. Emme H., Valldor M., Pöttgen R., and Huppertz H. Chem. Mater. 17 (2005) 2707
10. Haberer A., Heymann G., and Huppertz H. J. Solid State Chem. 180 (2007) 1595
11. Huppertz H., and von der Eltz B. J. Am. Chem. Soc. 124 (2002) 9376
12. Huppertz H. Z. Naturforsch. B58 (2003) 278
13. Huppertz H., and Emme H. J. Phys.: Condens. Matter 16 (2004) 1283
14. Emme H., and Huppertz H. Z. Anorg. Allg. Chem. 628 (2002) 2165
15. Emme H., and Huppertz H. Chem. Eur. J. 9 (2003) 3623
16. Emme H., and Huppertz H. Acta Crystallogr. C61 (2005) i29
17. Knyrim J.S., Roeßner F., Jakob S., Johrendt D., Kinski I., Glaum R., and Huppertz H. Angew. Chem. 119 (2007) 9256
18. Angew. Chem. Int. Ed. Engl. 46 (2007) 9097
19. Knyrim J.S., Schappacher F.M., Pöttgen R., Schmedt a J., dGünneJohrendt D., and Huppertz H. Chem. Mater. 19 (2007) 254
20. Knyrim J.S., and Huppertz H. Z. Naturforsch., B 63 (2008) 707
21. Knyrim J.S., and Huppertz H. J. Solid State Chem. 180 (2007) 742
22. Zayakina N.V., and Brovkin A.A. Kristallografiya 22 (1977) 275
23. Block S., and Perloff A. Acta Crystallogr. 19 (1965) 297
24. Froehlich R. Z. Kristallogr. 168 (1984) 109
25. Xue D., and Zhang S.J. Acta Crystallogr. B54 (1998) 652
26. Furmanova N.G., Maksimov B.A., Molchanov V.N., Kokh A.E., Kononova N.G., and Fedorov P.P. Crystallogr. Rep. 51 (2006) 219
27. Cordfunke E.H.P., Konings R.J.M., Van der Laan R.R., and Ouweljes W. J. Chem. Thermodyn. 25 (1993) 343
28. Hübner K.-H. N. Jb. Miner. Mh. (1969) 335
29. Krogh-Moe J., and Ihara M. Acta Crystallogr. B25 (1969) 2153
30. Manam J., and Sharma S.K. J. Mater. Sci. 39 (2004) 6203
31. Pan F., Shen G., Wang R., Wang X., and Shen D.J. Cryst. Growth 241 (2002) 108
32. Perloff A., and Block S. Acta Crystallogr. 20 (1966) 274
33. Corker D.L., and Glazer A.M. Acta Crystallogr. B52 (1996) 260
34. Machida K.-I., Adachi G.-Y., and Shiokawa J. Acta Crystallogr. B36 (1980) 2008
35. Huppertz H. Z. Kristallogr. 219 (2004) 330
36. Otwinowski Z., and Minor W. Methods Enzymol. 276 (1997) 307
37. Sheldrick G.M. SHELXS97 and SHELXL97: Program Suite for the Solution and Refinement of Crystal Structures (1997), University of Göttingen, Germany
38. Sheldrick G.M. Acta Crystallogr. A64 (2008) 112
39. Visser J.W. J. Appl. Crystallogr. 2 (1969) 89
40. POW Software (1998), STOE & CIE GmbH, Darmstadt, Germany
41. Hohenberg P., and Kohn W. Phys. Rev. B 136 (1964) 864
42. Kresse G., and Hafner J. Phys. Rev. B 47 (1993) 558-561
43. Kresse G., and Hafner J. Phys. Rev. B 49 (1994) 14251
44. Kresse G., and Furthmüller J. Comput. Mater. Sci. 6 (1996) 15
45. Kresse G., and Furthmüller J. Phys. Rev. B 54 (1996) 11169
46. Perdew J.P. In: Ziesche P., and Eschrig H. (Eds). Electronic Structures of Solids '91 (1991), Akademie Verlag, Berlin
47. Kresse G., and Joubert J. Phys. Rev. B 59 (1999) 1758
48. Monkhorst H.J., and Pack J.D. Phys. Rev. B 13 (1976) 5188
49. Murnaghan F.D. Proc. Natl. Acad. Sci. U.S.A. 30 (1944) 244
50. Birch F. J. Geophys. Res. 57 (1952) 227
51. Vinet P., Ferrante J., Smith J.R., and Rose J.H. Phys. Rev. B 35 (1987) 1945
52. Vinet P., Rose J.H., Ferrante J., and Smith J.R. J. Phys.: Condens. Matter 1 (1989) 1941
53. Liebau F. Structural Chemistry of Silicates (1985), Springer, Berlin
54. Robinson P.D., and Fang J.H. Am. Mineral. 62 (1977) 167
55. Krivovichev S.V., Yakovenchuk V.N., Armbruster T., Mikhailova Y., and Pakhomovsky Y.A. N. Jb. Miner. Mh. 8 (2004) 373
56. Hübenthal R. MAPLE - Program for the Calculation of MAPLE Values, Version 4 (1993), University of Gießen, Gießen, Germany
57. Zobetz E. Z. Kristallogr. 191 (1990) 45
58. Hawthorne F.C., Burns P.C., and Grice J.D. In: Grew E.S., and Anovitz L.M. (Eds). Boron: Mineralogy, Petrology and Geochemistry. second ed. vol. 33 (1996), Mineralogical Society of America, Washington 41
59. Emme H., Nikelski T., Schleid Th., Pöttgen R., Möller M.H., and Huppertz H. Z. Naturforsch., B 59 (2004) 202
60. Nikelski T., and Schleid Th. Z. Anorg. Allg. Chem. 629 (2003) 1017
61. Emme H., Heymann G., Haberer A., and Huppertz H. Z. Naturforsch. B62 (2007) 765
62. Emme H., Despotopoulou C., and Huppertz H. Z. Anorg. Allg. Chem. 630 (2004) 1717
63. Emme H., Despotopoulou C., and Huppertz H. Z. Anorg. Allg. Chem. 630 (2004) 2450
64. Clark J.R. Am. Mineral. 49 (1964) 1549
65. Konnert J.A., Clark J.R., and Christ C.L. Am. Mineral. 55 (1970) 1911
66. Ghose S., and Wan C. Am. Mineral. 62 (1977) 979
67. Prewitt C.T., and Shannon R.D. Acta Crystallogr. B24 (1968) 869
68. Brown I.D., and Altermatt D. Acta Crystallogr. B41 (1985) 244
69. Brese N.E., and O'Keeffe M. Acta Crystallogr. B47 (1991) 192
70. Hoppe R., Voigt S., Glaum H., Kissel J., Müller H.P., and Bernet K. J. Less-Common Met. 156 (1989) 105
71. Hoppe R. Angew. Chem. 78 (1966) 52
72. Angew. Chem., Int. Ed. Engl. 5 (1966) 95
73. Hoppe R. Angew. Chem. 82 (1970) 7
74. Angew. Chem., Int. Ed. Engl. 9 (1970) 25
75. Gerlach W. Z. Phys. 9 (1922) 184