American Mineralogist Crystal Structure Database

1 matching records for this search.

Feruvite
Download hom/feruvite.pdf
Grice J D, Robinson G W
Download cm/vol27/CM27_199.pdf
The Canadian Mineralogist 27 (1989) 199-203
Feruvite, a new member of the tourmaline group, and its crystal structure
Locality: Cuvier Island, New Zealand
16.012 16.012 7.245 90 90 120 R3m
atom      x      y      z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca        0      0  .2222  .62       .0167  .0167  .0197 .00835      0      0
Na        0      0  .2222  .38       .0167  .0167  .0197 .00835      0      0
Fe1  .12299 .06149 .63661  .51       .0102  .0073  .0119  .0051 -.0044 -.0022
Mg1  .12299 .06149 .63661 .403       .0102  .0073  .0119  .0051 -.0044 -.0022
Ti   .12299 .06149 .63661 .097       .0102  .0073  .0119  .0051 -.0044 -.0022
Al   .29832 .26167 .61132 .787       .0063  .0066  .0065  .0031  .0001  .0008
Mg2  .29832 .26167 .61132 .136       .0063  .0066  .0065  .0031  .0001  .0008
Fe2  .29832 .26167 .61132 .077       .0063  .0066  .0065  .0031  .0001  .0008
B    .11001 .22003 .45175            .0083  .0095  .0079  .0047 -.0003 -.0006
Si   .19151 .18985      0            .0057  .0055  .0067  .0026 -.0003 -.0005
O1        0      0  .7812            .0201  .0201  .0169 .01005      0      0
O2    .0607  .1214  .4764            .0119  .0065  .0147  .0032  .0010  .0020
O3    .2660  .1330  .5125            .0215  .0166  .0058  .0108  .0019  .0009
O4    .0919  .1838  .0710            .0088  .0168  .0114  .0084 -.0006 -.0012
O5    .1814  .0907  .0902            .0158  .0083  .0118  .0079  .0015  .0008
O6    .1953  .1862  .7789            .0114  .0107  .0080  .0061 -.0007 -.0016
O7    .2842  .2835  .0789            .0091  .0076  .0117  .0018 -.0029 -.0007
O8    .2088  .2695  .4411            .0069  .0110  .0184  .0041  .0006  .0020
H1        0      0   .725       .01
H2     .258   .129   .412       .01
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