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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:
***Click the ANX, Pearson or Wyckoff Symbol to find structures with that symbol***.
CC=74392 Help
TitleCrystallographic studies of dehydrated Ag+ and K+ exchanged zeolite A reacted with alkali metal vapor.
AuthorsKim, Y.;Jeong, M.S.;Seff, K.
ReferenceBulletin of the Korean Chemical Society (1993) 14, 603-609
Link XRef SCOPUS SCIRUS Google
CompoundAg4.5 Al17.5 Cs13 O48 Si6.5 - [Zeolite A] Silver caesium tecto-alumosilicate * [A4B13C24X48] [cP90] [m k i h g2 f c] []
Cell12.367(1), 12.367(1), 12.367(1), 90., 90., 90.
PM3-M (221) V=1891.44
RemarksR=0.087000 : DEF MIN =Zeolite A : PDF =45-187 : TEM =294 :
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.
At least one temperature factor is implausible or meaningless but agrees with the value given in the paper.
PDF 45-187 (with Rb)

Atom (site) Oxid. x, y, z, B, Occupancy
Si1(24k)4
Al1(24k)3
O1(12h)-2
O2(12i)-2
O3(24m)-2
Cs1(3c)1
Cs2(8g)1
Cs3(8g)1
Ag1(6f)1
00.1840(9)0.3722(9)00.2708
00.1840(9)0.3722(9)00.7292
00.231(3)0.501
00.286(2)0.286(2)01
0.112(1)0.112(1)0.350(2)01
00.50.501
0.2806(4)0.2806(4)0.2806(4)00.95
0.1100(7)0.1100(7)0.1100(7)00.3
0.343(3)0.50.500.75
Atom (site) Oxid. Beta11, Beta22, Beta33, Beta12, Beta13, Beta23
Si1(24k)4
Al1(24k)3
O1(12h)-2
O2(12i)-2
O3(24m)-2
Cs1(3c)1
Cs2(8g)1
Cs3(8g)1
Ag1(6f)1
0.0014(6)0.0006(7)0.0006(6)000.0005(5)
0.0014(6)0.0006(7)0.0006(6)000.0005(5)
0.013(6)-.002(3)0.003(3)000
0.003(3)0.002(1)0.002(1)000.002(3)
0.006(2)0.006(2)0.002(2)-.0015(20)0.0005(15)0.0005(15)
0.013(1)0.0055(6)0.0055(6)000
0.0078(2)0.0078(2)0.0078(2)0.0012(3)0.0012(3)0.0012(3)
0.0031(6)0.0031(6)0.0031(6)0.0000(5)0.0000(5)0.0000(5)
0.036(5)0.036(3)0.036(3)000

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