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American Mineralogist Crystal Structure Database

1 matching records for this search.

Carletonite
Download hom/carletonite.pdf 
Chao G Y
Download am/vol57/AM57_765.pdf 
American Mineralogist 57 (1972) 765-778
The crystal structure of carletonite, KNa4Ca4Si8O18(CO3)4(F,OH).H2O,
a double-sheet silicate
_database_code_amcsd 0000287
13.178 13.178 16.695 90 90 90 P4/mbm
atom      x     y     z  occ B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Si1   .0731 .2644 .4077 .965 .00102 .00124 .00080 -.00028 -.00012 -.00022
Si2   .2162 .1189 .3077 .972 .00114 .00105 .00085  .00021 -.00004  .00011
Al2   .2162 .1189 .3077 .028 .00114 .00105 .00085  .00021 -.00004  .00011
Ca    .0604 .1773 .1416 .940 .00098 .00096 .00073 -.00002 -.00002  .00000
K        .5     0 .2962 .882 .00291 .00291 .00227       0       0       0
Na1       0     0 .2754 .923 .00138 .00138 .00153       0       0       0
Na2   .1399 .6399 .1424 .905 .00247 .00247 .00179 -.00256 -.00130  .00130
Na3   .2227 .2773     0 .925 .00221 .00221 .00081 -.00131       0       0
C1    .2127 .0572     0      .00153 .00171 .00116  .00038       0       0
C2    .1197 .3803 .1674      .00257 .00257 .00180 -.00015  .00017 -.00017
O1    .1475 .1807 .3722      .00322 .00298 .00183  .00032  .00028 -.00086
O2    .2718 .0308 .3559      .00246 .00207 .00156  .00002 -.00049  .00013
O3    .1517 .0783 .2357      .00158 .00170 .00138 -.00008 -.00012 -.00008
O4    .3072 .1928 .2776      .00216 .00216 .00122 -.00009 -.00060  .00060
O5    .1251 .3749 .4020      .00234 .00234 .00177 -.00063  .00002 -.00002
O6    .0509 .2358    .5      .00275 .00236 .00162 -.00069       0       0
O7    .2110 .1046 .0674 .970 .00216 .00166 .00098  .00040  .00001 -.00007
O8    .1834 .3166 .1360 .984 .00175 .00175 .00172 -.00091  .00070 -.00070
O9    .0389 .2146     0 .969 .00154 .00449 .00086  .00045       0       0
O10   .0306 .3497 .1825 .913 .00146 .00136 .00201 -.00020  .00052 -.00071
Wat11     0     0 .4157 .791 .00596 .00596 .00298       0       0       0
Wat12 .4452 .0548     0 .554 .01242 .01242 .00949 -.00953       0       0
OH13      0     0 .1179  .59 .00164 .00164 .00149       0       0       0
F13       0     0 .1179  .41 .00164 .00164 .00149       0       0       0


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	Total number of retrieved datasets: 1

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