American Mineralogist Crystal Structure Database

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Ammoniojarosite
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Basciano L C, Peterson R C
 
Mineralogical Magazine 71 (2007) 427-441
The crystal structure of ammoniojarosite, (NH4)Fe3(SO4)2(OH)6 and the crystal chemistry
of the ammoniojarosite-hydronium jarosite solid-solution series
Locality: Synthetic
_database_code_amcsd 0014580
7.3177 7.3177 17.534 90 90 120 R-3m
atom     x      y      z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
N        0      0      0      .010   .012   .012   .007   .006      0      0
Fe     1/6   -1/6   -1/6      .006   .005   .005   .008   .003      0      0
S        0      0  .3059      .006   .006   .006   .006   .003      0      0
O1       0      0  .3891      .009   .011   .011   .007   .005      0      0
O2   .2231 -.2231 -.0564      .009   .011   .011   .009   .008      0      0
O3   .1277 -.1277  .1371      .008   .006   .006   .011   .003   .001   .001
H1    .176  -.176  -.118   .5 .027
H2    .059   .119   .018   .5 .027
H3       0      0  -.047   .5 .027
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