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Orschallite |
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Weidenthaler C, Tillmanns E, Hentschel G |
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Mineralogy and Petrology 48 (1993) 167-177 |
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Orschallite, Ca3(SO3)2SO4*12H2O, a new |
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calcium-sulfite-sulfate-hydrate mineral |
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Locality: Hannebacher Ley, Hannebach, Eifel, Germany |
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_database_code_amcsd 0014633 |
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11.350 11.350 28.321 90 90 120 R-3c |
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atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .79664 0 .25 1.52 .0178 .0221 .0193 .0111 -.0003 -.0006 |
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S1 0 0 .17258 1.48 .0202 .0202 .0157 .0101 0 0 |
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S2 0 0 0 1.71 .0179 .0179 .0294 .0090 0 0 |
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O1 .66707 .21142 .13729 1.87 .0277 .0190 .0274 .0139 -.0002 .0005 |
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Wat2 .66070 .99654 .18561 3.40 .0418 .0278 .0546 .0109 -.0252 .0047 |
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Wat3 .05881 .48933 .57787 2.90 .0302 .0402 .0406 .0181 -.0002 -.0007 |
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O4 0 0 .54872 .5 2.11 .0269 .0269 .0264 .0135 0 0 |
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O5 .08455 .13857 .02043 .5 2.53 .0255 .0209 .0404 .0044 -.0077 -.0057 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
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