Crystallography Open Database

Information card for entry 1552527

Preview

Coordinates	1552527.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Al3 Pd2 Yb
Calculated formula	Al3 Pd2 Yb
Title of publication	Temperature induced valence phase transition in intermediate-valent YbPd2Al3
Authors of publication	Stegemann, Frank; Stahl, Juliane; Bartsch, Manfred; Zacharias, Helmut; Johrendt, Dirk; Janka, Oliver
Journal of publication	Chemical Science
Year of publication	2019
a	9.2802 ± 0.0006 Å
b	9.2802 ± 0.0006 Å
c	4.2222 ± 0.0003 Å
α	90°
β	90°
γ	120°
Cell volume	314.91 ± 0.04 Å³
Cell temperature	90 K
Ambient diffraction temperature	90 K
Number of distinct elements	3
Space group number	191
Hermann-Mauguin space group symbol	P 6/m m m
Hall space group symbol	-P 6 2
Residual factor for all reflections	0.0169
Residual factor for significantly intense reflections	0.0157
Weighted residual factors for significantly intense reflections	0.036
Weighted residual factors for all reflections included in the refinement	0.0366
Goodness-of-fit parameter for significantly intense reflections	1.53
Goodness-of-fit parameter for all reflections included in the refinement	1.54
Diffraction radiation probe	x-ray
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
220521 (current)	2019-10-30	cif/ Adding structures of 1552521, 1552522, 1552523, 1552524, 1552525, 1552526, 1552527, 1552528, 1552529, 1552530, 1552531, 1552532 via cif-deposit CGI script.	1552527.cif