Crystallography Open Database

Information card for entry 4338337

Preview

Coordinates	4338337.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	In Nb O8 Te2
Calculated formula	In Nb O8 Te2
Title of publication	Strong Second Harmonic Generation (SHG) Originating from Combined Second-Order Jahn-Teller (SOJT) Distortive Cations in a New Noncentrosymmetric Tellurite, InNb(TeO4)2.
Authors of publication	Kim, Yeong Hun; Lee, Dong Woo; Ok, Kang Min
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	10
Pages of publication	5240 - 5245
a	7.6361 ± 0.0001 Å
b	10.8298 ± 0.0001 Å
c	7.6564 ± 0.0001 Å
α	90°
β	90°
γ	90°
Cell volume	633.165 ± 0.013 Å³
Cell temperature	298 ± 0.2 K
Ambient diffraction temperature	298 ± 0.2 K
Number of distinct elements	4
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0146
Residual factor for significantly intense reflections	0.0141
Weighted residual factors for significantly intense reflections	0.0295
Weighted residual factors for all reflections included in the refinement	0.0296
Goodness-of-fit parameter for all reflections included in the refinement	1.078
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179486 (current)	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 4/33/83.	4338337.cif
115692	2014-06-05	cif/ Updating files of 4338337 Original log message: Adding full bibliography for 4338337.cif.	4338337.cif
113022	2014-05-08	cif/ Adding structures of 4338337 via cif-deposit CGI script.	4338337.cif