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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=80879 Help
TitleCrystal structures of bromine sorption complexes of Ca(2+)-exchanged zeolite A.
AuthorsJang, S.B.;Song, S.H.;Kim, Y.
ReferenceBulletin of the Korean Chemical Society (1995) 16, 116-116
Link XRef SCOPUS Google
CompoundAl12 Br12 Ca4 Na4 O48 Si12 - [Zeolite A] Tetracalcium tetrasodium tecto-dodecaalumododecasilicate bromine (1/12) [ABC6N3X12] [cP92] [m l2 k i h g2] []
Cell12.214(1), 12.214(1), 12.214(1), 90., 90., 90.
PM3-M (221) V=1822.11
RemarksR=0.078000 : M =Zeolite A : P =45-178 : T =294 : D

Atom (site) Oxid. x, y, z, B, Occupancy
Si1(24k)4
Al1(24k)3
O1(12h)-2
O2(12i)-2
O3(24m)-2
Ca1(8g)2
Na1(8g)1
Br1(24l)0
Br2(24l)0
00.180.3700.5
00.180.3700.5
00.210.501
00.280.2801
0.100.100.3301
0.190.190.1900.5
0.150.150.1500.5
0.120.440.500.25
0.250.370.500.25
Atom (site) Oxid. Beta11, Beta22, Beta33, Beta12, Beta13, Beta23
Si1(24k)4
Al1(24k)3
O1(12h)-2
O2(12i)-2
O3(24m)-2
Ca1(8g)2
Na1(8g)1
Br1(24l)0
Br2(24l)0
0.000.000.0000-.00
0.000.000.00000
0.020.010.01000
0.010.010.01000.00
0.020.020.010.010.000.00
0.010.010.010.000.000.00
0.010.010.010.000.000.00
0.040.130.02-.0200
0.040.060.15-.0300

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