American Mineralogist Crystal Structure Database

2 matching records for this search.

Cymrite-K
 
Fasshauer D W, Chatterjee N D, Marler B
 
Physics and Chemistry of Minerals 24 (1997) 455-462
Synthesis, structure, thermodynamic properties, and stability
relations of K-cymrite, K[AlSi3O8].H2O
_database_code_amcsd 0008028
5.3348 5.3348 7.7057 90 90 120 P6/mmm
atom   x   y      z occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K      0   0      0     .03730
Al   1/3 2/3 .28831 .25 .01243
Si   1/3 2/3  .2883 .75 .01243
O1   1/2   0 .21369     .01419
O2   1/3 2/3    1/2     .01429
Wat    0   0    1/2             .0103  .0103  .2231  .0052      0      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Cymrite
Download hom/cymrite.pdf
Drits V A, Kashaev A A, Sokolova G V
 
Soviet Physics Crystallography 20 (1975) 171-175
Crystal structure of cymrite
Note: Y(O11) corrected
_database_code_amcsd 0015567
5.33 36.59999 7.67 90 90. 90 P2_1
atom      x      y      z occ
Ba1  -.0249 -.0015  .0083
Ba2   .5267  .1235  .0083
Ba3   .0292  .2485  .0083
Ba4   .5267  .3735 -.0083
Al1    .506  .0416   .280  .5
Si1    .506  .0416   .280  .5
Al2    .510  .0416  -.270  .5
Si2    .510  .0416  -.270  .5
Al3   .0092   .083   .304  .5
Si3   .0092   .083   .304  .5
Al4   .0204   .083  -.265  .5
Si4   .0204   .083  -.265  .5
Al5   .0292   .167   .302  .5
Si5   .0292   .167   .302  .5
Al6   .0283   .167  -.268  .5
Si6   .0283   .167  -.268  .5
Al7    .529   .208   .302  .5
Si7    .529   .208   .302  .5
Al8    .527   .208  -.260  .5
Si8    .527   .208  -.260  .5
Al9    .535   .292   .292  .5
Si9    .535   .292   .292  .5
Al10   .528   .292  -.265  .5
Si10   .528   .292  -.265  .5
Al11  .0308   .333   .302  .5
Si11  .0308   .333   .302  .5
Al12  .0308   .333  -.260  .5
Si12  .0308   .333  -.260  .5
Al13  .0304   .417   .300  .5
Si13  .0304   .417   .300  .5
Al14  .0204   .417  -.265  .5
Si14  .0204   .417  -.265  .5
Al15   .521   .458   .302  .5
Si15   .521   .458   .302  .5
Al16   .521   .458  -.267  .5
Si16   .521   .458  -.267  .5
O1     .516  .0416   .506
O2    .0158  .0835   .522
O3    .0375   .167   .514
O4     .525   .210   .516
O5     .536   .290   .516
O6    .0258   .333   .516
O7    .0204   .416   .520
O8     .510   .458   .516
O9     .474   .000   .194
O10    .544 -.0006  -.222
O11    .294   .072   .218
O12    .218   .050  -.221
O13    .766   .062   .185
O14    .750   .064  -.171
O15  -.0416   .125   .225
O16    .036   .125  -.180
O17    .311   .178   .230
O18    .770   .186  -.180
O19    .811   .196   .230
O20    .270   .189  -.180
O21    .453   .250   .230
O22    .527   .250  -.185
O23    .811   .304   .233
O24    .269   .311  -.174
O25    .324   .324   .240
O26    .770   .314  -.180
O27   -.047   .375   .230
O28    .025   .375  -.184
O29    .307   .431   .226
O30    .770   .436  -.180
O31    .805   .444   .225
O32    .267   .439  -.179
Wat1  -.025  -.002   .387  .5
Wat2   .527   .124   .387  .5
Wat3   .029   .248   .387  .5
Wat4   .527   .374  -.387  .5
Wat5  -.025   .006   .624  .5
Wat6   .527   .131   .624  .5
Wat7   .029   .256   .624  .5
Wat8   .527   .382  -.624  .5
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 2
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