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Pearceite |
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Bindi L, Evain M, Menchetti S |
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Acta Crystallographica B62 (2006) 212-219 |
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Temperature dependence of the silver distribution in the |
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crystal structure of natural pearceite, (Ag,Cu)16(As,Sb)2S11 |
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Sample: T = 120 K |
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Locality: Clara mine, Black Forest, Germany |
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_database_code_amcsd 0009934 |
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7.3721 7.3721 11.8104 90 90 120 P-3m1 |
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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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As 1/3 2/3 .40833 .5896 .01518 .01564 .01564 .0142 .00782 0 0 |
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Sb 1/3 2/3 .40833 .4104 .01518 .01564 .01564 .0142 .00782 0 0 |
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Ag1 .29992 .14996 .38548 .6724 .0361 .0493 .0274 .0387 .0247 -.0156 -.0078 |
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Cu1 .29992 .14996 .38548 .3276 .0361 .0493 .0274 .0387 .0247 -.0156 -.0078 |
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Ag2 .3567 .226 .12401 .324 .263 .0224 .50 .0230 -.055 .0021 -.003 |
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Ag3 .2857 .3745 .1160 .376 .0674 .106 .0315 .0310 .0092 -.0249 -.0007 |
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Ag4 .4538 -.092 .1137 .101 .083 .105 .130 .021 .065 -.0100 -.020 |
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Cu2 0 0 0 .0191 .0243 .0243 .0086 .01216 0 0 |
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S1 0 0 .18297 .0192 .0241 .0241 .0095 .0120 0 0 |
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S2 .01678 .50839 .31254 .0191 .0159 .0186 .0219 .00796 .0032 .00161 |
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S3 2/3 1/3 .0206 .0346 .0378 .0378 .0282 .0189 0 0 |
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S4 .0853 0 .5 1/6 .0179 .0138 .029 .0162 .0144 -.0018 -.0035 |
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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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