|
(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 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rhomboclase |
 |
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: Alcoparrosa, Chile |
|
_database_code_amcsd 0006292 |
|
9.6870 18.2040 5.4250 90 90 90 Pnma |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Fe 0 0 0 .010 .009 .015 .008 .001 .000 -.001 |
|
S .2353 .0886 .2923 .011 .009 .015 .008 .000 .000 .000 |
|
O1 .3227 .0232 .3417 .014 .011 .017 .014 .001 .003 -.001 |
|
O2 .0930 .0608 .2482 .015 .010 .024 .012 -.005 .002 -.001 |
|
O3 .2870 .1281 .0780 .018 .019 .021 .012 .005 -.005 -.002 |
|
O4 .2272 .1353 .5114 .015 .013 .019 .012 -.005 .000 .002 |
|
Ow1 .4904 .0903 .7262 .015 .013 .021 .012 -.003 .001 -.002 |
|
Ow2 .6334 .25 .5449 .033 .022 .018 .060 0 .010 0 |
|
Ow3a .3850 .25 .6056 .86 .024 .023 .017 .032 0 -.004 0 |
|
Ow3b .391 .25 .480 .14 .024 .023 .017 .032 0 -.004 0 |
|
H1 .428 .0965 .817 .031 |
|
H2 .565 .1015 .787 .039 |
|
H3 .681 .2131 .510 .045 |
|
H4 .337 .2105 .552 .045 |
|
H5 .495 .25 .56 .045 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
Multiple datasets can be concatenated into a single downloadable file by
selecting the datasets and then hitting the "Download Selected Data" button.
