American Mineralogist Crystal Structure Database

1 matching records for this search.

Prewittite
 
Shuvalov R R, Vergasova L P, Semenova T F, Filatov S K, Krivovichev S V,
Siidra O I, Rudashevsky N S
 
American Mineralogist 98 (2013) 463-469
Prewittite, KPb1.5Cu6Zn(SeO3)2O2Cl10, a new mineral from Tolbachik fumaroles,
Kamchatka peninsula, Russia: Description and crystal structure
Locality: Tolbachik fumaroles, Kamchatka peninsula, Russia
_database_code_amcsd 0019781
9.132 19.415 13.213 90 90 90 Pnnm
atom     x      y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
K1   .3982  .4456     .5 .22  .050  .0514  .0516  .0462 -.0069      0      0
K2      .5      0  .3409 .40 .0673  .0979  .0431  .0609 -.0106      0      0
Pb1     .5      0  .3409 .60 .0673  .0979  .0431  .0609 -.0106      0      0
Pb2  .4046 .09061      0 .85 .0435  .0497  .0413  .0395 -.0002      0      0
Zn   .3971  .1928     .5     .0377  .0334  .0388  .0408 -.0008      0      0
Cu1  .3302  .1310      0 .15  .045  .0529  .0333  .0484  .0017      0      0
Cu2  .4242  .4248      0     .0413  .0626  .0316  .0297  .0117      0      0
Cu3  .4174 .26232      0     .0308  .0345  .0320  .0257 -.0016      0      0
Cu4  .0824 .30985  .3150     .0332  .0351  .0283  .0360  .0022 -.0037 -.0073
Cu5  .2302 .19533  .1792     .0312  .0308  .0314  .0314  .0020  .0017 -.0076
Se   .4124 .34134 .22085     .0275  .0306  .0266  .0253  .0013 -.0007  .0026
O1   .4120  .1911  .1050      .031  .0361  .0268  .0299  .0009 -.0059 -.0004
O2   .0444  .2145  .2555      .032  .0355  .0325  .0281  .0043 -.0029 -.0036
O3   .2608  .2910  .2330      .031  .0264  .0254  .0422  .0022 -.0021 -.0044
O4   .4242  .3431  .0919      .035  .0411  .0309  .0342 -.0001  .0015  .0004
Cl1      0      0  .3768      .051  .0692  .0396  .0435  .0104      0      0
Cl2  .2211  .2788     .5      .043  .0412  .0458  .0418  .0077      0      0
Cl3  .1114  .2487      0      .041  .0401  .0450  .0374 -.0043      0      0
Cl4  .1611  .4495      0      .058  .0489  .0620  .0643 -.0069      0      0
Cl5  .1694  .0842  .1376     .0455  .0514  .0400  .0451  .0020 -.0009 -.0016
Cl6  .3606  .1341  .3546     .0495  .0591  .0478  .0416  .0024 -.0029 -.0072
Cl7  .1374  .4223  .3357     .0433  .0465  .0369  .0463  .0028 -.0026 -.0013
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