American Mineralogist Crystal Structure Database

1 matching records for this search.

Perloffite
Download hom/perloffite.pdf
Elliott P, Willis A C
 
Mineralogical Magazine 75 (2011) 317-325
The crystal structure of perloffite
Locality: Spring Creek copper mine, near Wilmington, South Australia
_database_code_amcsd 0019599
9.2425 12.470 5.002 90 100.19 90 P2_1/m
atom        x       y      z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ba     .54764     .75 .74105 .97 .0257  .0224  .0321  .0224      0 .00378      0
Sr     .54764     .75 .74105 .03 .0257  .0224  .0321  .0224      0 .00378      0
MnM1   .29812 -.10805 .20246 .57 .0260  .0227  .0279  .0272  .0000  .0037  .0010
Fe2+M1 .29812 -.10805 .20246 .38 .0260  .0227  .0279  .0272  .0000  .0037  .0010
CaM1   .29812 -.10805 .20246 .02 .0260  .0227  .0279  .0272  .0000  .0037  .0010
MgM1   .29812 -.10805 .20246 .02 .0260  .0227  .0279  .0272  .0000  .0037  .0010
NaM1   .29812 -.10805 .20246 .01 .0260  .0227  .0279  .0272  .0000  .0037  .0010
Fe3+M2 .09201  .39871 .13464 .97 .0218  .0199  .0254  .0200  .0001  .0030 -.0001
AlM2   .09201  .39871 .13464 .03 .0218  .0199  .0254  .0200  .0001  .0030 -.0001
P1      .1631     .75  .6811     .0217  .0191  .0284  .0177      0  .0034      0
P2     .33642  .44109  .7104     .0223  .0198  .0274  .0195  .0001  .0033 -.0002
O1      .2809     .75  .9372     .0297   .021   .043   .024      0   .001      0
O2      .2383     .75  .4318     .0252   .026   .027   .023      0  .0069      0
O3      .0668   .6492  .6795     .0277  .0273  .0306  .0274 -.0018  .0112 -.0035
O4      .3710   .5520  .6150     .0290  .0270   .030  .0303  .0006  .0066  .0009
O5      .2660   .4529  .9724     .0283  .0241   .039  .0235 -.0028  .0076 -.0052
O6      .2285   .3818  .4864     .0278  .0283   .031  .0213  .0009 -.0026 -.0016
O7      .4719   .3698  .7867     .0279  .0250   .031  .0278  .0034  .0058  .0058
Oh8     .1310     .25 -.0002     .0274   .033   .024   .026      0   .009      0
Oh9     .0616   .5588  .1944     .0254  .0260  .0286  .0213 -.0034  .0033 -.0015
H1       .092     .25  -.177       .05
H2       .044    .590   .350       .05
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