American Mineralogist Crystal Structure Database

2 matching records for this search.

Stephanite
Download hom/stephanite.pdf
Ribar B, Nowacki W
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=26&spage=201
Acta Crystallographica B26 (1970) 201-207
Die kristallstruktur von stephanit, [SbS3|S|Ag5]
_database_code_amcsd 0009367
7.873 12.467 8.583 90 90 90 Cmc2_1
atom      x      y      z B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Sb        0 .33072 .09900 .00802 .00249 .00379       0       0 -.00040
Ag1      .5 .35543 .16922 .01409 .00640 .01382       0       0  .00262
Ag2  .18902 .06219 .32683 .01874 .00883 .01157 -.00438  .00320  .03950
Ag3  .31406 .12312 .01357 .01654 .00673 .00601  .00327  .00033  .00192
S1        0 .03031 .02449 .00781 .00245 .00444       0       0 -.00080
S2       .5 .01522 .20585 .00861 .00194 .00463       0       0 -.00040
S3   .23005 .26679 .27307 .00781 .00209 .00667 -.00009 -.00049 -.00085
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View JMOL 3-D Structure (permalink)
 
Stephanite
Download hom/stephanite.pdf
Leitl M, Pfitzner A, Bindi L
 
Mineralogical Magazine 73 (2009) 17-26
Preferred ion diffusion pathways and activation energies for Ag in the
crystal structure of stephanite, Ag5SbS4
Locality: Freiberg District, Saxony, Germany
Note: y-coordinate of Sb altered by Bindi, June 2009
_database_code_amcsd 0014585
7.8329 12.458 8.5272 90 90 90 Cmc2_1
atom     x      y     z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Sb       0 .83095 .5143 .0305  .0323  .0323  .0268      0      0  .0009
Ag1  .1856 .12312 .6010 .0508  .0559  .0576  .0389 -.0102 -.0004 -.0109
Ag2  .3139  .0648 .2849 .0676  .0670  .0750  .0609  .0197  .0101 -.0239
Ag3     .5  .8549 .4456 .0587  .0512  .0577   .067      0      0 -.0184
S1      .5  .0276 .5917 .0335   .033   .038   .030      0      0   .005
S2       0  .0142 .4096 .0305   .031   .030   .031      0      0   .001
S3   .7706  .7670 .3464 .0326  .0324   .031   .034 -.0050 -.0029  .0020
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: 2
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