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=50653 Help
TitleCharacterization of ternary compounds in the Ba O:Fe2 O3 :TiO2 system: Ba6 Fe45 Ti17 O106 and Ba Fe11 Ti3 O23.
AuthorsVanderah, T.A.;Wong-Ng, W.;Toby, B.H.;Browning, V.M.;Shull, R.D.;Geyer, R.G.;Roth, R.S.
ReferenceIC&volume=143&fpage=182&details=yes target=icsd_help>Journal of Solid State Chemistry (1999) 143, 182-197
Link XRef SCOPUS Google
CompoundBa6 Fe43.7 O106 Ti18.3 - Barium iron titanium oxide (6/43.7/18.3/106) [A3B3C28X53] [mS348] [j34 i12 h3 g3 c a] []
Cell19.4119(4), 20.27769(40), 10.0831(2), 90., 105.2730(3), 90.
C12/M1 (12) V=3828.82
RemarksR=0.035300 : S T =298 : N

Atom (site) Oxid. x, y, z, B, Occupancy
Ba1(4g)2
Ba2(4i)2
Ba3(4h)2
Fe1(8j)2.902
Ti1(8j)4
Fe2(8j)2.902
Ti2(8j)4
Fe3(4i)2.902
Ti3(4i)4
Fe4(4i)2.902
Fe5(8j)2.902
Ti4(8j)4
Fe6(8j)2.902
Ti5(8j)4
Fe7(4i)2.902
Ti6(4i)4
Fe8(8j)2.902
Fe9(8j)2.902
Ti7(8j)4
Fe10(8j)2.902
Ti8(8j)4
Fe11(8j)2.902
Ti9(8j)4
Fe12(8j)2.902
Ti10(8j)4
Fe13(8j)2.902
Ti11(8j)4
Fe14(4i)2.902
Ti12(4i)4
Fe15(8j)2.902
Ti13(8j)4
Fe16(8j)2.902
Ti14(8j)4
Fe17(4i)2.902
Ti15(4i)4
Fe18(8j)2.902
Ti16(8j)4
O1(8j)-2
O2(2a)-2
O3(4i)-2
O4(4i)-2
O5(8j)-2
O6(8j)-2
O7(8j)-2
O8(8j)-2
O9(8j)-2
O10(8j)-2
O11(8j)-2
O12(4i)-2
O13(4g)-2
O14(8j)-2
O15(4i)-2
O16(4i)-2
O17(8j)-2
O18(8j)-2
O19(8j)-2
O20(8j)-2
O21(8j)-2
O22(4i)-2
O23(8j)-2
O24(8j)-2
O25(8j)-2
O26(8j)-2
O27(4h)-2
O28(8j)-2
O29(4h)-2
O30(4g)-2
O31(2c)-2
O32(8j)-2
O33(8j)-2
0.50.2100.401
0.2300.120.401
0.50.35-.50.401
0.430.34-.210.390.58
0.430.34-.210.390.42
0.430.07-.190.390.83
0.430.07-.190.390.17
0.560.5-.320.390.38
0.560.5-.320.390.62
0.270-.200.391
0.320.130.000.390.58
0.320.130.000.390.42
0.320.280.480.390.84
0.320.280.480.390.16
0.4200.050.390.77
0.4200.050.390.23
0.280.140.310.391
0.310.20-.260.390.90
0.310.20-.260.390.10
0.310.28-.010.390.94
0.310.28-.010.390.06
0.560.07-.300.390.53
0.560.07-.300.390.47
0.310.42-.490.390.80
0.310.42-.490.390.20
0.430.14-.440.390.55
0.430.14-.440.390.45
0.420.5-.220.390.40
0.420.5-.220.390.60
0.560.42-.050.390.60
0.560.42-.050.390.40
0.320.360.230.390.77
0.320.360.230.390.23
0.330-.490.390.40
0.330-.490.390.60
0.430.220.280.390.53
0.430.220.280.390.47
0.370.14-.130.531
0.50.500.531
0.610.5-.110.531
0.380-.140.531
0.250.070.380.531
0.370.28-.150.531
0.370.210.100.531
0.500.280.240.531
0.620.35-.100.531
0.370.20-.390.531
0.490.14-.260.531
0.500-.240.531
0.50.0600.531
0.380.07-.390.531
0.240-.400.531
0.3700.340.531
0.250.140.120.531
0.240.220.380.531
0.370.35-.400.531
0.370.060.100.531
0.500.43-.230.531
0.360.5-.390.531
0.230.14-.360.531
0.380.150.350.531
0.370.290.340.531
0.250.20-.110.531
0.50.070.50.531
0.380.42-.130.531
0.50.210.50.531
0.50.3600.531
0.50.50.50.531
0.250.07-.120.531
0.120.07-.350.531

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).