American Mineralogist Crystal Structure Database

1 matching records for this search.

Aminoffite
Download hom/aminoffite.pdf
Huminicki D M C, Hawthorne F C
Download cm/vol40/CM40_915.pdf
The Canadian Mineralogist 40 (2002) 915-922
Refinement of the crystal structure of aminoffite
_database_code_amcsd 0005773
9.809 9.809 9.844 90 90 90 *P4_2/n
.25 .25 .25
atom       x      y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca(1) .06286 .04403 .25852 .0096  .0111  .0099  .0079  .0043 -.0009 -.0025
Ca(2)    .25    .75 .25956 .0070  .0075  .0067  .0068  .0004      0      0
Si(1) .03770 .76281 .02968 .0066  .0065  .0068  .0066 -.0006 -.0010  .0001
Si(2)    .25    .25 .01020 .0063  .0063  .0057  .0069  .0000      0      0
Be     .0371  .7674  .5268 .0093  .0071  .0127  .0082  .0003  .0020 -.0001
O(1)   .3733  .6099  .0874 .0086  .0086  .0090  .0082 -.0016  .0002  .0003
O(2)   .1054  .6243  .0934 .0088  .0079  .0097  .0088  .0026  .0004  .0007
O(3)   .2328  .3865  .1010 .0080  .0094  .0061  .0084 -.0004  .0014 -.0004
O(4)   .6185  .7272  .0903 .0092  .0058  .0136  .0083 -.0006  .0005  .0007
O(5)   .7898  .4656  .1360 .0126  .0215  .0082  .0080  .0013  .0005  .0005
O(6)   .9669  .2339  .1341 .0091  .0102  .0102  .0070  .0003 -.0006 -.0011
H       .756   .548   .181 .0245
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