American Mineralogist Crystal Structure Database

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Sugilite
Download hom/sugilite.pdf
Armbruster T, Oberhansli R
Download am/vol73/AM73_595.pdf
American Mineralogist 73 (1988) 595-600
Crystal chemistry of double-ring silicates: Structures of sugilite and
brannockite
Note: x-coordinate of Na has been corrected
_database_code_amcsd 0001157
10.009 10.009 14.006 90 90 120 P6/mcc
atom      x      y      z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K         0      0    .25      .0164  .0164  .0196  .0082      0      0
Fe      1/3    2/3    .25 .83  .0047  .0047  .0046 .00235      0      0
Al      1/3    2/3    .25 .17  .0047  .0047  .0046 .00235      0      0
Li       .5     .5    .25       .017   .017   .016   .011      0      0
Si   .23633 .35620 .38678      .0066  .0071  .0057  .0036  .0005  .0006
O1    .1383  .3972      0       .019   .019  .0062  .0081      0      0
O2    .2232  .2774  .1377      .0130  .0155  .0161  .0104  .0005  .0007
O3    .1665  .5091 .17032      .0106  .0091  .0117  .0045 -.0013 -.0035
Na      1/3    2/3  .0134 .49  .0175  .0175   .026 .00875      0      0
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