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Schoenfliesite |
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Basciano L C, Peterson R C, Roeder P L |
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The Canadian Mineralogist 36 (1998) 1203-1210 |
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Description of schoenfliesite, MgSn(OH)6, and roxbyite, Cu1.72S, from a 1375 BC shipwreck, |
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and rietveld neutron-diffraction refinement of synthetic schoenfliesite, wickmanite, |
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MnSn(OH)6, and burtite, CaSn(OH)6 |
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Locality: a 1375 BC shipwreck |
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_database_code_amcsd 0005565 |
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7.7449 7.7449 7.7449 90 90 90 *Pn3 |
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.25 .25 .25 |
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atom x y z occ |
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Mg 0 0 0 |
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Sn .5 .5 .5 |
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H1 -.044 .1994 .2448 .5 |
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H2 -.222 .074 .219 .5 |
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O -.0619 .0751 .254 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Wickmanite |
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Basciano L C, Peterson R C, Roeder P L |
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The Canadian Mineralogist 36 (1998) 1203-1210 |
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Description of schoenfliesite, MgSn(OH)6, and roxbyite, Cu1.72S, from a 1375 BC shipwreck, |
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and rietveld neutron-diffraction refinement of synthetic schoenfliesite, wickmanite, |
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MnSn(OH)6, and burtite, CaSn(OH)6 |
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Locality: a 1375 BC shipwreck |
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_database_code_amcsd 0005566 |
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7.8744 7.8744 7.8744 90 90 90 *Pn3 |
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.25 .25 .25 |
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atom x y z occ |
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Mn 0 0 0 |
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Sn .5 .5 .5 |
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H1 -.0781 .202 .234 .5 |
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H2 -.201 .069 .270 .5 |
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O -.0643 .0755 .2586 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Burtite |
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Basciano L C, Peterson R C, Roeder P L |
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The Canadian Mineralogist 36 (1998) 1203-1210 |
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Description of schoenfliesite, MgSn(OH)6, and roxbyite, Cu1.72S, from a 1375 BC shipwreck, |
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and rietveld neutron-diffraction refinement of synthetic schoenfliesite, wickmanite, |
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MnSn(OH)6, and burtite, CaSn(OH)6 |
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Locality: a 1375 BC shipwreck |
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_database_code_amcsd 0005567 |
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8.1221 8.1221 8.1221 90 90 90 *Pn3 |
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.25 .25 .25 |
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atom x y z occ |
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Ca 0 0 0 |
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Sn .5 .5 .5 |
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H1 -.0346 .2011 .2869 .5 |
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H2 -.1805 .0638 .3026 .5 |
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O -.0663 .0787 .2694 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
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Siderotil |
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Peterson R C, Roeder P L, Zhang Y |
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The Canadian Mineralogist 41 (2003) 671-676 |
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The atomic structure of siderotil, (Fe,Cu)SO4.5H2O |
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_database_code_amcsd 0005844 |
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6.292 10.632 6.072 82.63 110.02 105.19 P-1 |
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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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CuM1 0 0 0 .54 .0270 .0275 .0297 .0233 .0073 .0072 -.0006 |
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FeM1 0 0 0 .35 .0270 .0275 .0297 .0233 .0073 .0072 -.0006 |
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ZnM1 0 0 0 .05 .0270 .0275 .0297 .0233 .0073 .0072 -.0006 |
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MgM1 0 0 0 .06 .0270 .0275 .0297 .0233 .0073 .0072 -.0006 |
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FeM2 1/2 1/2 0 .76 .0214 .0205 .0255 .0183 .0066 .0063 .0015 |
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FeM2 1/2 1/2 0 .11 .0214 .0205 .0255 .0183 .0066 .0063 .0015 |
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FeM2 1/2 1/2 0 .13 .0214 .0205 .0255 .0183 .0066 .0063 .0015 |
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S .0301 .2886 .6519 .0204 .0177 .0254 .0168 .0052 .0046 .0008 |
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O1 .9256 .1519 .7050 .0323 .028 .030 .032 .000 .008 .002 |
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O2 .2628 .3269 .8290 .0300 .024 .031 .027 .005 -.001 .001 |
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O3 .8838 .3748 .6554 .0295 .025 .041 .026 .015 .006 -.003 |
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O4 .0581 .2988 .4177 .0303 .034 .041 .021 .012 .012 .001 |
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Wat5 .8283 .0750 .1585 .0349 .039 .035 .035 .006 .018 -.004 |
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Wat6 .3097 .1173 .1807 .0327 .034 .028 .034 .002 .011 -.002 |
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Wat7 .4765 .4040 .3171 .0316 .030 .043 .021 .009 .009 .006 |
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Wat8 .7603 .4061 .0277 .0328 .029 .047 .028 .020 .009 .000 |
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Wat9 .4476 .1302 .6631 .0373 .027 .043 .037 .008 .008 .007 |
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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
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