Crystallography Open Database

Information card for entry 4330278

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Structure parameters

Formula	Bi39.615 Cu5.671 Li6.72 O120 P20
Calculated formula	Bi39.616 Cu5.664 Li6.72 O120 P20
Title of publication	Inorganic Polar Blocks into Controlled Acentric Assemblies
Authors of publication	Diana Endara; Marie Colmont; Marielle Huvé; Frederic Capet; Julien Lejay; P. Aschehoug; Olivier Mentre
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	9557 - 9562
a	11.5048 ± 0.001 Å
b	5.4565 ± 0.0006 Å
c	41.656 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2615 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	40
Hermann-Mauguin space group symbol	B b m 2
Hall space group symbol	B 2 -2b
Residual factor for all reflections	0.0877
Residual factor for significantly intense reflections	0.0487
Weighted residual factors for significantly intense reflections	0.0604
Weighted residual factors for all reflections included in the refinement	0.0697
Goodness-of-fit parameter for significantly intense reflections	1.54
Goodness-of-fit parameter for all reflections included in the refinement	1.41
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71069 Å
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181932 (current)	2016-04-07	hkl/4/ (antanas@echidna.ibt.lt) Adding svn headers to multiple entries in subrange 4/33.	4330278.cif 4330278.hkl
180708	2016-04-02	hkl/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4330278.cif 4330278.hkl
179405	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/02.	4330278.cif 4330278.hkl
79530	2013-04-05	cif/ hkl/ Adding structures of 4330278 via cif-deposit CGI script.	4330278.cif 4330278.hkl