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Gladite |
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Topa D, Makovicky E, Balic-Zunic T |
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The Canadian Mineralogist 40 (2002) 1147-1159 |
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The structural role of excess Cu and Pb in gladite and krupkaite |
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based on new refinements of their structure |
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Sample: bd33 |
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_database_code_amcsd 0005780 |
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4.0044 33.575 11.480 90 90 90 Pmcn |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Bi1 .25 .39201 .50696 .0421 .0388 .0442 .0432 0 0 .0040 |
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Bi2 .75 .48687 .65683 .0434 .0434 .0456 .0412 0 0 -.0007 |
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Bi3 .25 .05623 .52112 .0415 .0388 .0412 .0444 0 0 .0030 |
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Bi4 .75 .27078 .47365 .0424 .0399 .0470 .0404 0 0 .0021 |
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Bi5 .75 .15429 .64885 .0439 .0438 .0447 .0432 0 0 -.0031 |
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Pb .25 .16511 .31833 .0485 .0477 .0512 .0468 0 0 .0049 |
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Cu .25 .23783 .7205 .0490 .048 .055 .043 0 0 -.002 |
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S1 .75 .3516 .6086 .040 .043 .038 .039 0 0 .004 |
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S2 .75 .4581 .4482 .039 .039 .039 .039 0 0 .000 |
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S3 .25 .4333 .7088 .037 .037 .035 .039 0 0 -.001 |
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S4 .75 .0178 .6279 .041 .040 .040 .042 0 0 .002 |
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S5 .75 .1190 .4484 .039 .038 .038 .040 0 0 .002 |
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S6 .75 .2306 .2743 .039 .039 .038 .038 0 0 .000 |
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S7 .25 .3132 .3714 .040 .043 .037 .041 0 0 -.001 |
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S8 .25 .2081 .5379 .040 .041 .044 .037 0 0 .000 |
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S9 .25 .1023 .7130 .037 .037 .037 .039 0 0 -.001 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
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Gladite |
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Topa D, Makovicky E, Balic-Zunic T |
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The Canadian Mineralogist 40 (2002) 1147-1159 |
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The structural role of excess Cu and Pb in gladite and krupkaite |
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based on new refinements of their structure |
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Sample: bd39 |
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_database_code_amcsd 0005781 |
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4.0100 33.589 11.502 90 90 90 Pmcn |
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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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Bi1 .25 .39243 .50808 .0363 .0339 .0374 .0377 0 0 .0044 |
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Bi2 .75 .48697 .65794 .0407 .0379 .0429 .0414 0 0 .0032 |
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Bi3 .25 .05679 .52041 .0358 .0338 .0343 .0392 0 0 .0022 |
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Bi4 .75 .27130 .47335 .0360 .0343 .0394 .0343 0 0 .0020 |
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Bi5 .75 .15535 .64725 .0397 .0406 .0398 .0386 0 0 -.0035 |
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Pb .25 .16514 .31690 .0422 .0431 .0431 .0405 0 0 .0040 |
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Cu1 .25 .23800 .7207 .0419 .042 .046 .037 0 0 -.004 |
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Cu2 .75 .4318 .2672 .223 .042 |
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S1 .75 .3517 .6088 .033 .036 .032 .032 0 0 .001 |
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S2 .75 .4574 .4484 .033 .035 .031 .033 0 0 .000 |
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S3 .25 .4332 .7091 .031 .034 .027 .032 0 0 .001 |
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S4 .75 .0180 .6268 .033 .035 .032 .032 0 0 .001 |
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S5 .75 .1192 .4480 .032 .035 .029 .032 0 0 .001 |
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S6 .75 .2307 .2753 .032 .033 .028 .034 0 0 .000 |
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S7 .25 .3132 .3702 .034 .038 .031 .032 0 0 .000 |
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S8 .25 .2082 .5385 .035 .038 .036 .031 0 0 .000 |
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S9 .25 .1023 .7126 .031 .035 .027 .032 0 0 -.001 |
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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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Gladite |
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Petricek V, Makovicky E |
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The Canadian Mineralogist 44 (2006) 189-206 |
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Interpretation of selected structures of the bismuthinite - aikinite |
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series as commensurately modulated structures |
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Sample: superspace refinement |
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_database_code_amcsd 0006075 |
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4.0044 33.5754 11.4795 90 90 90 Pmcn |
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atom x y z |
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Cu .25 .23789 .7206 |
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PbM21 .25 .16509 .31807 |
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BiM22 .25 .51313 .34316 |
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BiM23 .25 .84572 .35117 |
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BiM11 .25 .05623 .52112 |
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BiM12 .25 .39201 .50692 |
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BiM13 .25 .72923 .52636 |
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S11 .25 -.01777 .3723 |
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S12 .25 .31306 .3710 |
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S13 .25 .64840 .3919 |
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S21 .25 .20821 .5380 |
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S22 .25 .54190 .5518 |
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S23 .25 .88090 .5515 |
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S31 .25 .10229 .7134 |
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S32 .25 .43318 .7088 |
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S33 .25 .76942 .7255 |
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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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Gladite |
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Petricek V, Makovicky E |
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The Canadian Mineralogist 44 (2006) 189-206 |
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Interpretation of selected structures of the bismuthinite - aikinite |
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series as commensurately modulated structures |
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Sample: supercell refinement |
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_database_code_amcsd 0006076 |
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4.0044 33.5754 11.4795 90 90 90 Pmcn |
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atom x y z |
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Cu .25 .23789 .7206 |
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PbM21 .25 .16509 .31807 |
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BiM22 .25 .51313 .34316 |
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BiM23 .25 .84572 .35117 |
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BiM11 .25 .05623 .52112 |
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BiM12 .25 .39201 .50692 |
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BiM13 .25 .72923 .52636 |
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S11 .25 -.01777 .3723 |
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S12 .25 .31306 .3710 |
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S13 .25 .64840 .3919 |
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S21 .25 .20821 .5380 |
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S22 .25 .54189 .5518 |
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S23 .25 .88089 .5515 |
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S31 .25 .10229 .7134 |
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S32 .25 .43318 .7088 |
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S33 .25 .76942 .7255 |
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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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Gladite |
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Petricek V, Makovicky E |
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The Canadian Mineralogist 44 (2006) 189-206 |
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Interpretation of selected structures of the bismuthinite - aikinite series as |
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commensurately modulated structures |
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Locality: synthetic |
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_database_code_amcsd 0006077 |
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4.0044 11.198 11.4795 90 90 90 Pmcn |
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atom x y z occ Uiso |
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Cu .25 .7137 .7206 .33 .0499 |
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PbM2 .25 .52394 .33747 .338 .0466 |
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BiM2 .25 .52394 .33747 .662 .0466 |
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BiM1 .25 .17747 .51813 .0432 |
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S1 .25 -.0563 .3784 .0413 |
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S2 .25 .6310 .5471 .0410 |
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S3 .25 .3049 .7159 .0391 |
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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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| |
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Gladite |
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Petricek V, Makovicky E |
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The Canadian Mineralogist 44 (2006) 189-206 |
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Interpretation of selected structures of the bismuthinite - aikinite series as |
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commensurately modulated structures |
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Locality: synthetic |
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Sample: oversubstituted gladite |
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_database_code_amcsd 0006078 |
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4.0100 11.1963 11.502 90 90 90 Pmcn |
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atom x y z occ Uiso |
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Cu1 .25 .7141 .7206 .25 .0426 |
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Cu2 .25 .7057 .7324 .138 .040 |
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PbM2 .25 .52284 .33716 .3975 .04163 |
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BiM2 .25 .52284 .33716 .6025 .04163 |
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BiM1 .25 .17793 .51838 .03650 |
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S1 .25 -.0563 .3782 .0330 |
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S2 .25 .6317 .5473 .0344 |
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S3 .25 .3052 .7158 .0324 |
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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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Gladite |
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Kohatsu I, Wuensch B J |
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Acta Crystallographica B32 (1976) 2401-2409 |
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The crystal structure of gladite, PbCuBi5S9, a superstructure intermediate in |
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the series Bi2S3-PbCuBiS3 (bismuthinite-aikinite) |
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_database_code_amcsd 0009571 |
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33.531 11.486 4.003 90 90 90 Pbnm |
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atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Pb .3349 .3174 .25 .00020 .0028 .02 -.00022 0 0 |
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Cu .2390 .2200 .25 .00012 .0005 .006 .00002 0 0 |
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Bi1 .0565 .0209 .25 .00025 .0020 .011 .0001 0 0 |
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Bi2 .3924 .0056 .25 .00030 .0027 .016 .00007 0 0 |
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Bi3 .7294 .0283 .25 .00045 .0016 .01 -.00005 0 0 |
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Bi4 .6550 .3542 .25 .00034 .0033 .019 .00018 0 0 |
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Bi5 .9866 .3430 .25 .00019 .0025 .019 .00002 0 0 |
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S1 .2095 .0354 .25 .00019 .0014 .01 -.00011 0 0 |
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S2 .5415 .0552 .25 .00041 .0031 .03 -.00008 0 0 |
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S3 .8804 .0565 .25 .00022 .0027 .02 .00007 0 0 |
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S4 .1855 .3786 .25 .00008 .0011 .011 .00004 0 0 |
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S5 .5172 .3760 .25 .00026 .0028 .022 .00004 0 0 |
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S6 .8511 .3917 .25 .00046 .0035 .02 -.00016 0 0 |
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S7 .1006 .2158 .25 .00001 .0005 .001 -.00004 0 0 |
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S8 .4344 .2038 .25 .00039 .0034 .039 -.00006 0 0 |
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S9 .7669 .2290 .25 .00045 .0037 .028 .00006 0 0 |
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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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Gladite |
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Synecek V, Hybler J |
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Neues Jahrbuch fur Mineralogie, Monatshefte 1974 (1974) 541-560 |
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The crystal structures of krupkaite, CuPbBi3S6, and of gladite, CuPbBi5S9, |
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and the classification of superstructures in the bismuthinite-aikinite group, |
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Locality: Krupka, Ore Mountains, NW-Bohemia |
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_database_code_amcsd 0014751 |
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33.62 11.48 4.00 90 90 90 Pbnm |
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atom x y z |
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Bi(Al) .228 .020 .25 |
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Bi(A2) .057 .480 .75 |
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Bi(A3) .392 .485 .75 |
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Bi(B1) .155 .352 .25 |
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Bi(B2) .487 .343 .25 |
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Pb(B3) .334 .185 .75 |
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S(1,1) .046 .504 .25 |
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S(1,2) .213 .460 .75 |
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S(1,3) .379 .058 .25 |
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S(2,1) .017 .364 .25 |
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S(2,2) .185 .129 .75 |
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S(2,3) .348 .382 .25 |
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S(3,1) .104 .275 .75 |
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S(3,2) .274 .233 .25 |
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S(3,3) .438 .280 .75 |
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Cu .235 .280 .75 |
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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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