Information card for entry 8100293

Structure parameters

• Formula: Al B Ba F2 O3
• Calculated formula: Al B Ba F2 O3
• Title of publication: Reinvestigation of the crystal structure of barium aluminum borate difluoride, BaAlBO~3~F~2~, a new nonlinear optical material
• Authors of publication: Hu, Zhang-Gui; Maramatsu, Kenichi; Kanehisa, N.; Yoshimura, M.; Mori, Y.; Sasaki, T.; Kai, Y.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2003
• Journal volume: 218
• Journal issue: 1
• Pages of publication: 1 - 2
• a: 4.8879 ± 0.0006 Å
• b: 4.8879 ± 0.0006 Å
• c: 9.403 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 194.54 ± 0.03 ų
• Cell temperature: 296 K
• Number of distinct elements: 5
• Space group number: 174
• Hermann-Mauguin space group symbol: P -6
• Hall space group symbol: P -6
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No