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Deliensite |
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Plasil J, Hauser J, Petricek V, Meisser N, Mills S J, Skoda R, Fejfarova K, |
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Cejka J, Sejkora J, Hlousek J, Johannet J M, Machovic V, Lapcak L |
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Mineralogical Magazine 76 (2012) 2837-2860 |
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Crystal structure and formula revision of deliensite, Fe[(UO2)2(SO4)2(OH)2](H2O)7 |
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Locality: Jeronym mine, Abertamy, Czech Republic |
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_database_code_amcsd 0019801 |
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15.8514 16.2478 6.8943 90 90 90 Pnn2 |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Fe .0313 .3099 0 .58 .0158 .019 .021 .007 -.002 -.002 .006 |
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Mg .0313 .3099 0 .27 .0158 .019 .021 .007 -.002 -.002 .006 |
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Zn .0313 .3099 0 .16 .0158 .019 .021 .007 -.002 -.002 .006 |
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U1 .28494 .29041 .012550 .0112 .0202 .0083 .0052 -.0010 -.0060 -.004 |
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U2 .29072 .05284 .010290 .0139 .0278 .0076 .0064 .0002 .003 -.003 |
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S1 .2358 .3330 .50649 .0116 |
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S2 .2444 .0086 .51334 .0145 |
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O1 .1784 .3012 .00789 .012 |
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O2 .1848 .0363 .01462 .021 |
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O3 .4023 .0640 .00972 .021 |
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O4 .1835 .2568 .50583 .010 |
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O5 .1791 .4028 .48903 .015 |
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O6 .3005 .338 .34101 .019 |
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O7 .2081 .5022 .18478 .008 |
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O8 .3108 .0103 .34383 .008 |
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O9 .2009 .0883 .50838 .008 |
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O10 .3095 .4309 .00030 .008 |
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O11 .3887 .2809 .00812 .012 |
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OH12 .2866 .174 .20460 .007 |
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OH13 .2339 .673 .32240 .007 |
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O14 .2843 .336 .68480 .002 |
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Wat15 .4001 .1773 .51124 .024 |
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Wat16 .5417 .0702 .38544 .045 |
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Wat17 .5378 .2366 .23119 .036 |
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Wat18 .0282 .1852 .10716 .046 |
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Wat19 .0358 .3546 .29215 .033 |
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Wat20 .465 .420 .33372 .052 |
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Wat21 .024 .087 .41914 .075 |
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View JMOL 3-D Structure (permalink) |
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