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=68809 Help
TitleDetermination of the incommensurately modulated structure of Mo8O23 by means of single-crystal X-ray diffraction.
AuthorsKomdeur, A.J.H.;de Boer, J.L.;van Smaalen, S.
ReferenceIC&volume=2&fpage=45&details=yes target=icsd_help>Journal of Physics: Condensed Matter (1990) 2, 45-54
Link XRef SCOPUS Google
CompoundMo8 O23 - Molybdenum oxide (8/23) [A8X23] [mP62] [g15 c] []
Cell13.382(1), 4.052(6), 16.877(2), 90., 106.197(3), 90.
P12/C1 (13) V=878.81
RemarksR=0.029000 : P =5-339 : M
Given b was doubled, i.e. y-values were halved

Atom (site) Oxid. x, y, z, B, Occupancy
Mo1(4g)5.75
Mo2(4g)5.75
Mo3(4g)5.75
Mo4(4g)5.75
O1(2c)-2
O2(4g)-2
O3(4g)-2
O4(4g)-2
O5(4g)-2
O6(4g)-2
O7(4g)-2
O8(4g)-2
O9(4g)-2
O10(4g)-2
O11(4g)-2
O12(4g)-2
0.060.580.4101
0.180.410.2401
0.310.580.0701
0.440.400.4001
00.5001
0.060.000.4101
0.190.990.2401
0.310.000.0701
0.440.980.4001
0.060.490.1601
0.120.490.3301
0.190.490.4901
0.260.510.1601
0.320.490.3201
0.410.500.0001
0.450.490.1501
Atom (site) Oxid. Beta11, Beta22, Beta33, Beta12, Beta13, Beta23
Mo1(4g)5.75
Mo2(4g)5.75
Mo3(4g)5.75
Mo4(4g)5.75
O1(2c)-2
O2(4g)-2
O3(4g)-2
O4(4g)-2
O5(4g)-2
O6(4g)-2
O7(4g)-2
O8(4g)-2
O9(4g)-2
O10(4g)-2
O11(4g)-2
O12(4g)-2
0.000.000.00-.000.000.00
0.000.000.00-.000.000.00
0.000.000.000.000.00-.00
0.000.000.00-.000.00-.00
0.000.000.000.000.000.00
0.000.000.00-.000.000.00
0.000.000.000.000.00-.00
0.000.000.000.000.00-.00
0.000.000.00-.000.00-.00
0.000.000.000.00-.000.00
0.000.000.000.000.00-.00
0.000.000.000.00-.000.00
0.000.000.000.000.000.00
0.000.000.000.00-.00-.00
0.000.000.000.000.000.00
0.000.000.000.000.000.00

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).