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Twinnite |
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Makovicky E, Topa D |
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Zeitschrift fur Kristallographie 227 (2012) 468-475 |
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Twinnite, Pb0.8Tl0.1Sb1.3As0.8S4, the OD character and the question of its polytypism |
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Locality: Jas Roux, France |
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_database_code_amcsd 0019818 |
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7.997 19.517 8.634 90 91.061 90 P2_1/n |
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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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PbMe1 .08755 .80109 .89603 .98 .0464 .0549 .0372 .0477 .0031 .0142 .0049 |
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SbMe1 .08755 .80109 .89603 .02 .0464 .0549 .0372 .0477 .0031 .0142 .0049 |
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PbMe2 .57952 .70454 .88681 .98 .0555 .0774 .0392 .0487 -.0214 -.0332 .0153 |
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SbMe2 .57952 .70454 .88681 .02 .0555 .0774 .0392 .0487 -.0214 -.0332 .0153 |
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SbMe3 .80549 .97285 .40298 .0243 .0212 .0265 .0249 .0017 -.0047 -.0002 |
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SbMe4 .51555 .88957 .11032 .0249 .0218 .0201 .0325 -.0010 -.0052 .0009 |
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AsMe5 .1578 .99710 .1420 .87 .0264 .0241 .0362 .0190 .0013 -.0001 .0072 |
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SbMe5 .1578 .99710 .1420 .13 .0264 .0241 .0362 .0190 .0013 -.0001 .0072 |
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AsMe6 .4793 .87182 .6428 .62 .0261 .0272 .0259 .0250 .0008 -.0040 -.0024 |
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SbMe6 .4793 .87182 .6428 .38 .0261 .0272 .0259 .0250 .0008 -.0040 -.0024 |
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S1 .4988 .5773 .1000 .0207 .014 .027 .020 .002 -.006 .002 |
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S2 .6675 .8494 .8483 .0209 .020 .025 .017 -.001 -.001 .001 |
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S3 .6561 1.0368 .6728 .0350 .026 .056 .023 .010 .000 .003 |
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S4 .4584 .5895 .6761 .0217 .022 .028 .015 -.001 .002 -.001 |
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S5 .2988 .9439 .9363 .0234 .017 .034 .020 .005 -.001 -.001 |
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S6 .3558 .7832 .1339 .0274 .029 .012 .041 -.004 -.007 .000 |
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S7 .1497 .6597 .9358 .0301 .039 .022 .029 -.003 -.012 -.003 |
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S8 .3324 .7665 .6531 .0283 .024 .028 .033 -.003 -.007 .004 |
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