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American Mineralogist Crystal Structure Database

1 matching records for this search.

Favreauite
 
Mills S J, Kampf A R, Christy A G, Housley R M, Thorne B, Chen Y S, Steele I M
 
European Journal of Mineralogy 26 (2014) 771-781
Favreauite, a new selenite mineral from the El Dragon mine, Bolivia
Note: T = 100 K
Locality: El Dragon mine, Potosi Department, Bolivia
_database_code_amcsd 0020444
9.860 9.860 9.700 90 90 90 *P4/n
.25 -.25 0
atom      x      y      z   occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1     .75    .25      1   .95 .01474 .01472 .01472  .0148      0      0      0
Ca1     .75    .25      1   .17 .01474 .01472 .01472  .0148      0      0      0
Bi2     .75    .75 .51701    .9 .00427 .00424 .00424  .0043      0      0      0
Cu1      .5     .5     .5 .9683  .0096  .0120  .0094  .0075 -.0039  .0013  .0013
Cu2  .73943 .51655 .27943 .9683 .01080  .0094  .0128  .0102 -.0001  .0006 -.0047
Se   .56624 .53945 .82772       .00979  .0105  .0104  .0084 -.0047 -.0003 -.0009
O1    .6097  .6215  .3859        .0071   .007   .006   .008 -.0026 -.0005 -.0002
O2    .3974  .5656  .8447        .0192   .007   .029   .022   .000  -.002  -.012
O3    .6010  .5667  .6605        .0253   .026   .041   .008  -.024   .000   .007
O4    .5787  .3661  .8419        .0183   .021   .014   .019  -.001  -.015   .000
Wat5    .25    .25  .8979         .030   .034   .034   .021      0      0      0
OH6   .6781  .3367  .4365   .20   .063   .047   .084   .059   .050   .033   .043
OH7     .75    .25     .5   .20   .033   .032   .032   .033      0      0      0
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Total number of retrieved datasets: 1
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