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Lanmuchangite |
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Nyburg S C, Steed J, Aleksovska S, Petrusevski V M |
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Acta Crystallographica B56 (2000) 204-209 |
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Structure of the alums. I. On the sulfate group disorder in the alpha-alums |
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Locality: synthetic |
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Sample: T = 296 K |
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_database_code_amcsd 0009915 |
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12.2305 12.2305 12.2305 90 90 90 Pa3 |
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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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Tl .5 .5 .5 .0519 .0519 .0519 .0519 .0083 .0083 .0083 |
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Al 0 0 0 .0196 .0196 .0196 .0196 -.0002 -.0002 -.0002 |
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S .31138 .31138 .31138 .0259 .0259 .0259 .0259 .0037 .0037 .0037 |
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O3 .2434 .2434 .2434 .843 .0650 .0650 .0650 .0650 -.0166 -.0166 -.0166 |
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O3A .3779 .3779 .3779 .157 .1300 .130 .130 .130 -.052 -.052 -.052 |
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O4 .2676 .4232 .3157 .843 .0465 .0640 .0342 .0417 .0240 .0205 .0103 |
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O4A .2918 .2065 .368 .157 .0640 .067 .044 .082 .026 .052 .040 |
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O1 .1521 .01508 -.0144 .0284 .0226 .0355 .0271 -.0034 .0007 .0021 |
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O2 .04606 .13994 .29729 .0405 .0457 .0351 .0408 .0025 -.0076 -.0060 |
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H11 .176 .028 -.066 .037 |
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H12 .192 .018 .038 .040 |
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H21 .1140 .1732 .293 .104 |
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H22 .004 .1919 .2958 .120 |
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