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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=95625 Help
TitleStructural modifications of dodecatungstophosphoric acid hexahydrate induced by temperature in the 10 - 358 K range. In situ high-resolution neutron powder diffraction investigation.
AuthorsKremenovic, A.;Spasojevic-de Bire, A.;Bouree, F.;Colomban, P.;Dimitrijevic, R.;Davidovic, M.;Mioc, U.B.
ReferenceIC&volume=150&fpage=431&details=yes target=icsd_help>Solid State Ionics (2002) 150, 431-442
Link XRef SCOPUS Google
CompoundH4.5 D10.5 O46 P1 W12 - Hydrogen deuterium dodecatungstophosphate(V) dideuteriohydrate hydrate (0.9/2.1/1/3.6/8.4) [AB12X46] [cP148] [l k4 h e d a] []
Cell12.1607(3), 12.1607(3), 12.1607(3), 90, 90, 90
PN3-MZ (224) V=1798.36
RemarksR=0.022700 : N T =338 : D

Atom (site) Oxid. x, y, z, B, Occupancy
W1(24k)6
P1(2a)5
O1(8e)-2
O2(24k)-2
O3(24k)-2
O4(24k)-2
O5(24h)-2
H1(48l)1
D1(48l)1
H2(6d)1
D2(6d)1
0.750.950.950.011
0.750.750.750.021
0.810.810.810.011
0.650.650.500.011
0.870.870.020.021
0.730.050.050.021
0.750.140.250.040.5
0.740.100.180.030.15
0.740.100.180.030.35
0.750.250.250.040.3
0.750.250.250.040.7

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