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Parnauite |
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Mills S J, Kampf A R, McDonald A M, Bindi L, Christy A G, Kolitsch U, Favreau G |
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European Journal of Mineralogy 25 (2013) 693-704 |
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The crystal structure of parnauite: a copper arsenate-sulphate |
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with translational disorder of structural rods |
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Locality: Majuba Hill, Nevada, USA |
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_database_code_amcsd 0020147 |
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3.0113 14.259 14.932 90 90 90 Pmn2_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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Cu1 0 .1379 .2337 .0170 .0096 .0332 .0082 0 0 .0020 |
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Cu2 .5 -.2549 .0515 .0244 .0228 .0326 .0176 0 0 -.0008 |
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Cu3 0 -.3268 .8733 .0222 .0150 .0334 .0183 0 0 .0016 |
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Cu4 .5 .0716 .0548 .0242 .0135 .051 .0082 0 0 -.0035 |
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Cu5 0 -.2118 .2232 .5 .048 .070 .047 .026 0 0 -.004 |
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Cu6 0 .0423 -.1297 .5 .0180 .025 .028 .001 0 0 -.002 |
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As1 0 -.1059 .1853 .5 .0257 .029 .030 .018 0 0 -.004 |
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As2 0 -.0780 -.0789 .5 .0154 .012 .022 .012 0 0 -.001 |
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O1 .5 .1721 .1517 .016 |
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O2 0 -.0875 -.1905 .025 |
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O3 0 .0064 .1356 .029 |
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O4 0 -.1956 -.0236 .044 |
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O5 .5 -.3575 -.0423 .026 |
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O6 .5 -.1605 .1511 .033 |
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O7 0 -.298 .119 .084 |
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O8 .5 -.0191 -.0467 .029 |
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O9 0 -.1060 .3002 .044 |
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O10 0 .2927 .2970 .017 |
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O11 0 .142 -.020 .087 |
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Wat1 0 .396 .061 .129 |
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Wat2 0 -.500 .830 .109 |
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Wat3 0 -.503 .177 .17 |
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Wat4 0 -.316 .310 .150 |
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View JMOL 3-D Structure (permalink) |
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