American Mineralogist Crystal Structure Database

1 matching records for this search.

Gatedalite
 
Halenius U, Bosi F
 
Mineralogical Magazine 79 (2015) 625-634
Gatedalite, Zr(Mn2+2Mn3+4)SiO12, a new mineral species of the braunite
group from Langban, Sweden
Locality: Langban deposit, Langban, Sweden
_database_code_amcsd 0020385
9.4668 9.4668 18.8701 90 90 90 *I4_1/acd
0 -.25 .125
atom       x      y      z  occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
Zr1        0    .25   .125  .49 .01083 .01221 .01221  .0081 -.00546       0       0
Mn1        0    .25   .125  .40 .01083 .01221 .01221  .0081 -.00546       0       0
Mg1        0    .25   .125  .07 .01083 .01221 .01221  .0081 -.00546       0       0
Ca1        0    .25   .125  .02 .01083 .01221 .01221  .0081 -.00546       0       0
Zn1        0    .25   .125  .01 .01083 .01221 .01221  .0081 -.00546       0       0
Ce1        0    .25   .125  .01 .01083 .01221 .01221  .0081 -.00546       0       0
Mn3+2      0      0      0  .96 .00999 .01020 .01138  .0084 -.00289 -.00112  .00136
Mn2+2      0      0      0  .01 .00999 .01020 .01138  .0084 -.00289 -.00112  .00136
Mg2        0      0      0 .025 .00999 .01020 .01138  .0084 -.00289 -.00112  .00136
Al2        0      0      0 .005 .00999 .01020 .01138  .0084 -.00289 -.00112  .00136
Mn3+3    .25 .21715      0 .445 .00958 .01018 .00998  .0086       0  .00147       0
Fe3      .25 .21715      0  .29 .00958 .01018 .00998  .0086       0  .00147       0
Mn2+3    .25 .21715      0  .17 .00958 .01018 .00998  .0086       0  .00147       0
Mg3      .25 .21715      0 .095 .00958 .01018 .00998  .0086       0  .00147       0
Mn3+4 .23539 .48539   .125 .815 .00984 .01062 .01062  .0083 -.00049  .00047 -.00047
Mn2+4 .23539 .48539   .125  .10 .00984 .01062 .01062  .0083 -.00049  .00047 -.00047
Mg4   .23539 .48539   .125 .085 .00984 .01062 .01062  .0083 -.00049  .00047 -.00047
Si         0    .25   .375       .0079  .0075  .0075  .0088       0       0       0
O1    .14641 .85765 .94603       .0156  .0173  .0136  .0158  -.0024  -.0038   .0001
O2    .13889 .07817 .05840       .0175  .0238  .0170  .0117  -.0055  -.0053   .0008
O3    .08203 .13707 .92473       .0152  .0166  .0147  .0144   .0017  -.0017   .0016
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