Crystallography Open Database

Information card for entry 4118291

Preview

Coordinates	4118291.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	praseodymium iron borocarbide
Formula	C34 Al0.04 B18 Fe12.96 Pr33
Calculated formula	C34 Al0.04 B18 Fe12.96 Pr33
Title of publication	A Tale of Two Metals: New Cerium Iron Borocarbide Intermetallics Grown from Rare-Earth/Transition Metal Eutectic Fluxes
Authors of publication	Patricia C. Tucker; Jason Nyffeler; Banghao Chen; Andrew Ozarowski; Ryan Stillwell; Susan E. Latturner
Journal of publication	Journal of the American Chemical Society
Year of publication	2012
Journal volume	134
Pages of publication	12138 - 12148
a	14.3881 ± 0.0009 Å
b	14.3881 ± 0.0009 Å
c	14.3881 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	2978.6 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	229
Hermann-Mauguin space group symbol	I m -3 m
Hall space group symbol	-I 4 2 3
Residual factor for all reflections	0.0137
Residual factor for significantly intense reflections	0.0127
Weighted residual factors for significantly intense reflections	0.0271
Weighted residual factors for all reflections included in the refinement	0.0273
Goodness-of-fit parameter for all reflections included in the refinement	1.233
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
178953 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/82.	4118291.cif
75815	2013-03-13	cif/ Adding structures of 4118291 via cif-deposit CGI script.	4118291.cif