American Mineralogist Crystal Structure Database

1 matching records for this search.

Feruvite
Download hom/feruvite.pdf
Gadas P, Novak M, Cempirek J, Filip J, Galiova M V, Groat L A, Vsiansky D
The Canadian Mineralogist 52 (2014) 285-301
Mineral assemblages, compositional variation, and crystal structure of feruvitic
tourmaline from a contaminated anatectic pegmatite at Mirosov near Strazek,
Moldanubian zone, Czech Republic
Note: site occupancies from typical X-ray diffraction analysis
Locality: Mirosov, Moldanubian zone, Czech Republic
_database_code_amcsd 0020666
16.0047 16.0047 7.2120 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  .21562 .424  .0147  .0121  .0121  .0201 .00603       0       0
Na         0       0  .21562 .576  .0147  .0121  .0121  .0201 .00603       0       0
FeY  .121449 .060724  .63711 .735 .00735 .00829 .00509 .00973 .00415 -.00384 -.00192
MgY  .121449 .060724  .63711 .265 .00735 .00829 .00509 .00973 .00415 -.00384 -.00192
AlZ  .298212  .26149  .61103 .948 .00476 .00461 .00495 .00453 .00224  .00001  .00052
FeZ  .298212  .26149  .61103 .052 .00476 .00461 .00495 .00453 .00224  .00001  .00052
Si   .191762 .190127       0      .00432 .00415 .00384 .00483 .00189 -.00029 -.00059
B     .11020  .22040   .4522       .0060  .0056  .0059  .0067  .0030   .0002   .0005
O1         0       0   .7867       .0186  .0176  .0176  .0205  .0088       0       0
O2    .06085  .12169   .4760       .0106  .0113  .0049  .0135 .00243  .00079   .0016
O3    .26752  .13376  .51154      .01124  .0189  .0123  .0046  .0095   .0011  .00055
O4    .09233  .18466  .07091      .00881  .0066  .0133  .0088  .0066 -.00043  -.0009
O5    .18308  .09154  .09101      .00908  .0141  .0064  .0093  .0070   .0017  .00086
O6    .19644  .18751 -.22206      .00735  .0085  .0083  .0050  .0040  -.0002  -.0011
O7    .28480  .28448  .07979      .00767  .0067  .0057  .0082  .0013  -.0021  -.0013
O8    .20935  .27013  .44104      .00898  .0040  .0089  .0137  .0030   .0010   .0023
H3      .261   .1307    .390        .067
H1         0       0    .898         .34
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