Crystallography Open Database

Information card for entry 2100858

Preview

Coordinates	2100858.cif
Original IUCr paper	HTML

Structure parameters

Formula	Ba O3 Ti
Calculated formula	Ba O3 Ti
Title of publication	Structural parameters and electron difference density in BaTiO~3~
Authors of publication	Buttner, R. H.; Maslen, E. N.
Journal of publication	Acta Crystallographica Section B
Year of publication	1992
Journal volume	48
Journal issue	6
Pages of publication	764 - 769
a	3.9998 ± 0.0008 Å
b	3.9998 ± 0.0008 Å
c	4.018 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	64.28 ± 0.02 Å³
Sample thermal history	heated to 1323K and cooled by approximately 15 K h -1
Number of distinct elements	3
Hermann-Mauguin space group symbol	P 4 m m
Hall space group symbol	P 4 -2
Residual factor for all reflections	0.013
Weighted residual factors for all reflections	0.013
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	Mo
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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