ICSD for WWW

Details of the selected entries


1 entry selected.
CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
***Click the ANX, Pearson or Wyckoff Symbol to find structures with that symbol***.
CC=62919 Help
TitleStructure of tetragonal Y Ba2 Cu3 O5.8.
AuthorsKatano, S.;Funahashi, S.;Hatano, T.;Matsushita, A.;Nakamura, K.;Matsumoto, T.;Ogawa, K.
ReferenceIC&volume=26&fpage=104&details=yes target=icsd_help>Japanese Journal of Applied Physics, Par (1987) 26, 104-105
Link XRef SCOPUS Google
CompoundBa2 Cu3 O5.8 Y1 - Yttrium barium copper oxide (1/2/3/5.8) - prepared at T = 950 C [AB2C3X6] [tP12] [i h g2 f d a] []
Cell3.8607(3), 3.8607(3), 11.774(1), 90., 90., 90.
P4/MMM (123) V=175.49
RemarksR=0.029900 : D N T =10 :
At least one temperature factor missing in the paper.
Deviation of the charge sum from zero tolerable.

Atom (site) Oxid. x, y, z, B, Occupancy
Y1(1d)3
Ba1(2h)2
Cu1(1a)2
Cu2(2g)2
O1(2f)-2
O2(2g)-2
O3(4i)-2
0.50.50.501
0.50.50.1901
00001
000.3601
0.50000.07
000.1501
0.500.3700.91

Demo database


Copying or publishing either the ICSD data or software without written permission is illegal.
The ICSD database is copyright © 2018 by Fachinformationszentrum (FIZ) Karlsruhe
The PHP-mySQL WWW interface is copyright © 2003-2015 by Peter Hewat
The 3D crystal structure visualisation software, xtal-3d is copyright © 1994-2015 by Marcus Hewat
The PHP-JMOL drawing software is copyright © 2006-2015 by Alan Hewat
Please report technical problems with ICSD for WWW to alan.hewat[a]neutronoptics.com (Alan Hewat).