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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=65440 Help
TitleNeutron powder diffraction study of a Na, Cs-Rho zeolite.
AuthorsBaur, W.H.;Bieniok, A.;Shannon, R.D.;Prince, E.
ReferenceZeitschrift fuer Kristallographie (1989) 187, 253-266
Link XRef SCOPUS Google
CompoundD12.4 Al11.6 Cs3.2 Na6.2 O102.2 Si36.4 - [Zeolite Rho] Sodium caesium tecto-alumosilicate dideuteriohydrate * [AB2C16X34] [cI172] [h2 g7 c b] []
Cell14.6566(4), 14.6566(4), 14.6566(4), 90., 90., 90.
I4-3M (217) V=3148.47
RemarksR=0.080100 : D M =Zeolite Rho : N P =39-192 : T =373 :
At least one temperature factor missing in the paper.
The coordinates are those given in the paper but the atomic distances do not agree with those calculated during testing.The coordinates are probably correct.
Deviation of the charge sum from zero tolerable.
PDF 39-192, mean T-O: 1.636, R(Bragg)=0.0965, the positions O4,

Atom (site) Oxid. x, y, z, B, Occupancy
Si1(48h)4
Al1(48h)3
O1(48h)-2
O2(24g)-2
O3(24g)-2
Cs1(6b)1
Na1(8c)1
Na2(24g)1
O4(24g)-2
O5(24g)-2
O6(24g)-2
D1(24g)1
0.260.120.421.0(0.75
0.260.120.421.0(0.24
0.020.200.382.0(1
0.200.200.392.1(1
0.130.130.621.6(1
000.52.900.53
0.300.300.303.(10.25
0.040.040.503.(10.17
0.210.210.123.(10.08
0.040.040.163.(10.09
0.430.430.283.(10.07
00.51

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