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ICSD for WWW : Details

ICSD for WWW

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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=30503 Help
TitleStructure de l'Hydrogenophosphate D'Argent.
AuthorsTordjman, I.;Boudjada, A.;Guitel, J.C.;Masse, R.
ReferenceActa Crystallographica B (1978) 34, 3723-3725
Link XRef SCOPUS SCIRUS Google
CompoundH1 Ag2 O4 P1 - Silver hydrogenphosphate [AB2X4] [hP24] [c2 a3] []
Cell6.190(2), 6.190(2), 9.015(6), 90., 90., 120.
P3112 (151) V=299.14
RemarksR=0.052000 : COA
The coordinates given in the paper contain an error. The values in the database have been corrected.
At least one temperature factor missing in the paper.
Hydrogen coordinates calculated

Atom (site) Oxid. x, y, z, B, Occupancy
Ag1(3a)1
Ag2(3a)1
P1(3a)5
O1(6c)-2
O2(6c)-2
H1(3b)1
-.0818(1)0.0818(1)0.333301
0.2051(1)-.2051(1)0.333301
0.5087(3)-.5087(3)0.333301
0.2667(1)0.4123(1)0.4147(1)01
0.4609(1)0.2750(1)0.2247(1)01
0.621.240.166701
Atom (site) Oxid. Beta11, Beta22, Beta33, Beta12, Beta13, Beta23
Ag1(3a)1
Ag2(3a)1
P1(3a)5
O1(6c)-2
O2(6c)-2
H1(3b)1
0.0119(3)0.0119(3)0.0074(2)0.0022(3)-.0022(1)-.0022(1)
0.0244(5)0.0244(5)0.0031(1)0.0174(6)-.0011(1)-.0011(1)
0.0058(6)0.0058(6)0.0032(4)0.0010(8)-.0006(3)-.0006(3)
0.0185(28)0.0092(22)0.0080(9)0.0004(19)-.0009(14)-.0026(12)
0.0168(26)0.0089(21)0.0065(24)0.0024(19)-.0021(13)-.0041(11)
000000

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