American Mineralogist Crystal Structure Database

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Jarosite
Download hom/jarosite.pdf
Scarlett N V Y, Grey I E, Brand H E A
Download am/vol95/AM95_1590.pdf
American Mineralogist 95 (2010) 1590-1593
Ordering of iron vacancies in monoclinic jarosites
Locality: synthetic
Note: T = 95 C
_database_code_amcsd 0017748
12.74852 7.34697 6.98243 90 127.1974 90 C2/m
atom     x     y     z  occ Biso
Na       0     0     0  .75 1.08
H3O      0     0     0  .25 1.08
Fe1      0     0    .5 .856 1.08
Fe2    .75   .25    .5      1.08
S    .3066     0 .9329      1.08
O1   .4091     0  .198      1.13
O2   .1679     0  .829      1.13
O3   .3423 .1656 .8460      1.13
OH4  .2603     0  .400  .92 1.13
Wat4 .2603     0  .400  .08 1.13
OH5  .0743 .2023 .3943  .92 1.13
Wat5 .0743 .2023 .3943  .08 1.13
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