American Mineralogist Crystal Structure Database

3 matching records for this search.

Staurolite
Download hom/staurolite.pdf
Koch-Muller M, Kahlenberg V, Bubenick W, Gottschalk M
 
European Journal of Mineralogy 10 (1998) 453-460
Crystal-structure refinement of synthetic Fe- and Mg-staurolite by
Rietveld analysis of X-ray powder-diffraction data
Sample: Mg-staurolite synthesized at 25 kbar
_database_code_amcsd 0006726
7.8791 16.5425 5.6329 90 90 90 Ccmm
atom     x     y     z occ  Uiso
MgT2 .3877     0   .25 .53 .0155
AlT2 .3877     0   .25 .04 .0155
SiT1 .1344 .1672   .25 .98 .0035
AlT1 .1344 .1672   .25 .02 .0035
AlM1    .5 .1737     0 .97 .0050
MgM1    .5 .1737     0 .03 .0050
AlM2 .2631 .4101   .25 .97 .0060
MgM2 .2631 .4101   .25 .03 .0060
AlM3     0     0     0 .43 .0057
MgM3     0     0     0 .03 .0057
MgM4    .5     0     0 .22 .0083
O1   .2361     0 .9770     .0086
O2   .2559 .1627 .0116     .0044
O3   .0043 .0856   .25     .0068
O4   .0205 .2508   .25     .0047
O5   .5253 .0934   .25     .0047
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Staurolite
Download hom/staurolite.pdf
Koch-Muller M, Kahlenberg V, Bubenick W, Gottschalk M
 
European Journal of Mineralogy 10 (1998) 453-460
Crystal-structure refinement of synthetic Fe- and Mg-staurolite by
Rietveld analysis of X-ray powder-diffraction data
Sample: Fe-staurolite synthesized at 25 kbar
_database_code_amcsd 0006727
7.8719 16.6231 5.6583 90 90 90 Ccmm
atom     x     y     z occ  Uiso
FeT2 .3942     0   .25 .71 .0149
AlT2 .3942     0   .25 .15 .0149
SiT1 .1324 .1654   .25 .95 .0039
AlT1 .1324 .1654   .25 .05 .0039
AlM1    .5 .1734     0 .97 .0050
FeM1    .5 .1734     0 .03 .0050
AlM2 .2681 .4106   .25 .97 .0060
FeM2 .2681 .4106   .25 .03 .0060
AlM3     0     0     0 .48 .0065
FeM4    .5     0     0 .05 .0135
O1   .2352     0 .9667     .0096
O2   .2532 .1614 .0143     .0060
O3   .0011 .0882   .25     .0084
O4   .0192 .2463   .25     .0059
O5   .5317 .0989   .25     .0059
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Staurolite
Download hom/staurolite.pdf
Koch-Muller M, Kahlenberg V, Bubenick W, Gottschalk M
 
European Journal of Mineralogy 10 (1998) 453-460
Crystal-structure refinement of synthetic Fe- and Mg-staurolite by
Rietveld analysis of X-ray powder-diffraction data
Sample: Fe-staurolite synthesized at 5 kbar
Note: These coordinates do not reproduce the reported bond lengths, but
Koch-Muller tells me that the coordinates are correct, and the reported
bond lengths were incorrect.
_database_code_amcsd 0006728
7.8783 16.6172 5.6591 90 90 90 Ccmm
atom     x     y     z occ  Uiso
FeT2 .3952     0   .25 .78 .0149
AlT2 .3952     0   .25 .08 .0149
SiT1 .1307 .1648   .25 .95 .0039
AlT1 .1307 .1648   .25 .05 .0039
AlM1    .5 .1752     0 .97 .0050
FeM1    .5 .1752     0 .03 .0050
AlM2 .2696 .4105   .25 .97 .0060
FeM2 .2696 .4105   .25 .03 .0060
AlM3     0     0     0 .52 .0065
FeM4    .5     0     0 .01 .0135
O1   .2405     0 .9661     .0096
O2   .2544 .1626 .0138     .0060
O3   .0000 .0864   .25     .0084
O4   .0222 .2443   .25     .0059
O5   .5302 .0987   .25     .0059
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 3
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