American Mineralogist Crystal Structure Database

1 matching records for this search.

Shimazakiite
 
Kusachi I, Kobayashi S, Takechi Y, Nakamuta Y, Nagase T, Yokoyama K,
Momma K, Miyawaki R, Shigeoka M, Matsubara S
Mineralogical Magazine 77 (2013) 93-105
Shimazakiite-4M and shimazakiite-4O, Ca2B2O5, two polytypes of a new mineral
from Fuka, Okayama Prefecture, Japan
Note: polytype Shimazakiite-4O
Locality: Fuka, Okayama Prefecture, Japan
_database_code_amcsd 0019799
3.55645 6.35194 19.2534 90 90 90 P2_12_12_1
atom      x      y       z   Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3)  U(2,3)
Ca1  .29761 .20104 .210507 .00757  .0082  .0072 .00734 -.00008 .00001 -.00052
Ca2  .79738 .44688 .061518 .00791  .0078  .0088  .0072  .00011 .00014 -.00019
B1    .1863  .7181  .15670  .0079  .0061  .0090  .0084  -.0011 -.0006   .0026
B2    .1426  .5033  .41790  .0074  .0070  .0051  .0101   .0012 -.0006  -.0007
O1    .7986 .05583  .01528  .0094  .0104  .0106  .0071   .0011 -.0002   .0017
O2    .7950 .14306  .13453  .0091  .0093  .0098  .0082   .0021 -.0011  -.0040
O3    .3157 .51855  .14809  .0105  .0117  .0093  .0105   .0030  .0014   .0019
O4    .0037 .80046  .09633  .0114  .0198  .0071  .0072   .0036 -.0030  -.0007
O5    .2079 .82822  .21757  .0097  .0123  .0091  .0078  -.0012 -.0004   .0002
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