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=400310 Help
TitleCrystal structure of aluminium dicalcium pentasodium tetrakis(phosphate), Na5 Ca2 Al (P O4)4.
AuthorsAlkemper, J.;Paulus, H.;Fuess, H.
ReferenceZeitschrift fuer Kristallographie (1994) 209, 76-76
Link XRef SCOPUS Google
CompoundAl1 Ca2 Na5 O16 P4 - Pentasodium dicalcium aluminium tetrakis(phosphate(V)) [AB2C4D5X16] [mS112] [a28] []
Cell11.071(3), 13.951(4), 10.511(3), 90., 119.34(1), 90.
C1C1 (9) V=1415.2
RemarksR=0.022200 : P =84-2464 :

Atom (site) Oxid. x, y, z, B, Occupancy
Ca1(4a)2
Ca2(4a)2
Na1(4a)1
Na2(4a)1
Na3(4a)1
Na4(4a)1
Na5(4a)1
P1(4a)5
P2(4a)5
P3(4a)5
P4(4a)5
Al1(4a)3
O1(4a)-2
O2(4a)-2
O3(4a)-2
O4(4a)-2
O5(4a)-2
O6(4a)-2
O7(4a)-2
O8(4a)-2
O9(4a)-2
O10(4a)-2
O11(4a)-2
O12(4a)-2
O13(4a)-2
O14(4a)-2
O15(4a)-2
O16(4a)-2
0.090.100.0701
0.550.100.5201
0.050.120.5101
0.050.370.5501
0.220.490.3701
0.430.320.2201
0.240.010.8801
0.400.040.7001
0.240.250.8901
0.270.240.3601
0.400.460.7101
0.330.250.6601
0.420.150.7001
0.48-.000.6401
0.450.010.8601
0.240.020.6101
0.210.250.7301
0.390.250.9901
0.170.340.9001
0.170.160.9101
0.220.260.4701
0.430.260.4501
0.250.140.3101
0.210.310.2401
0.430.350.7301
0.480.510.6501
0.440.510.8601
0.240.470.6101
Atom (site) Oxid. U11, U22, U33, U12, U13, U23
Ca1(4a)2
Ca2(4a)2
Na1(4a)1
Na2(4a)1
Na3(4a)1
Na4(4a)1
Na5(4a)1
P1(4a)5
P2(4a)5
P3(4a)5
P4(4a)5
Al1(4a)3
O1(4a)-2
O2(4a)-2
O3(4a)-2
O4(4a)-2
O5(4a)-2
O6(4a)-2
O7(4a)-2
O8(4a)-2
O9(4a)-2
O10(4a)-2
O11(4a)-2
O12(4a)-2
O13(4a)-2
O14(4a)-2
O15(4a)-2
O16(4a)-2
0.000.010.000.000.000.00
0.010.000.00-0.00.00-0.0
0.010.010.020.000.00-0.0
0.010.010.020.000.000.00
0.020.020.010.000.01-0.0
0.010.020.01-0.00.00-0.0
0.020.010.020.000.01-0.0
0.000.000.000.000.000.00
0.000.000.000.000.000.00
0.000.000.00-0.00.000.00
0.000.000.00-0.00.00-0.0
0.000.000.00-0.00.00-0.0
0.010.000.020.000.000.00
0.020.010.020.000.01-0.0
0.010.010.000.000.000.00
0.000.010.01-0.00.000.00
0.010.020.00-0.00.00-0.0
0.000.010.01-0.00.00-0.0
0.020.010.020.000.010.00
0.010.010.01-0.00.000.00
0.010.010.000.000.00-0.0
0.000.010.01-0.00.000.00
0.020.010.02-0.00.01-0.0
0.010.030.010.000.000.01
0.010.000.01-0.00.00-0.0
0.020.010.02-0.00.010.00
0.010.010.00-0.00.00-0.0
0.000.010.010.000.00-0.0

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).