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CC=Collection Code: [AB2X4]=ANX Form: [cF56]=Pearson: [e d a]=Wyckoff Symbol: [Al2MgO4]=Structure Type:
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CC=62149 Help
TitleOrthorhombic perovskite Ca Ti O3 and Cd Ti O3: structure and space group.
AuthorsSasaki, S.;Prewitt, C.T.;Bass, J.D.
ReferenceIC&volume=43&fpage=166&details=yes target=icsd_help>Acta Crystallographica C (1987) 43, 166-167
Link XRef SCOPUS Google
CompoundCa1 O3 Ti1 - [Perovskite] Calcium titanate [ABX3] [oP20] [d c2 b] []
Cell5.3796(1), 5.4423(3), 7.6401(5), 90., 90., 90.
PBNM (62) V=223.68
RemarksR=0.023000 : P =42-423 : M =Perovskite :

Atom (site) Oxid. x, y, z, B, Occupancy
Ca1(4c)2
Ti1(4b)4
O1(4c)-2
O2(8d)-2
-.000.030.2501
00.5001
0.070.480.2501
0.710.280.0301
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
Ca1(4c)2
Ti1(4b)4
O1(4c)-2
O2(8d)-2
0.000.000.00-.0000
0.000.000.000.000.000.00
0.000.000.000.0000
0.000.000.00-.000.00-.00

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