American Mineralogist Crystal Structure Database

1 matching records for this search.

(H3O)Fe(SO4)2
 
Peterson R C, Valyashko E, Wang R
The Canadian Mineralogist 47 (2009) 625-634
The atomic structure of (H3O)Fe3+(SO4)2 and rhomboclase, (H5O2)Fe3+(SO4)2*2H2O
Locality: synthetic
_database_code_amcsd 0006291
4.801 8.271 8.311 70.605 89.959 89.951 P-1
atom      x     y     z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe    .7501 .0115 .2467 .014   .005   .032   .009  -.012   .000  -.001
S1    .2502 .7902 .4797 .014   .011   .019   .011  -.006   .001   .000
S2    .7502 .7811 .9961 .012   .011   .020   .007  -.006   .000   .000
O1    .4200 .8648 .3251 .020   .011   .040   .011  -.012   .004  -.004
O2   -.0392 .8608 .4418 .018   .007   .039   .008  -.009  -.001  -.003
O3    .3614 .8410 .6200 .022   .015   .048   .008  -.016  -.008   .010
O4    .2830 .6061 .5314 .038
O5    .8658 .8609 .1180 .019   .016   .032   .013  -.013  -.003   .003
O6    .9283 .8346 .8423 .017   .005   .037   .013  -.015   .004  -.002
O7    .4666 .8395 .9512 .023   .004   .054   .008  -.008   .000  -.001
O8    .7600 .6020 .0830 .017
O9H3  .7502 .5031 .7451 .022   .018   .026   .022  -.009  -.001  -.001
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