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Damaraite |
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Krivovichev S V, Burns P C |
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European Journal of Mineralogy 13 (2001) 801-809 |
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Crystal chemistry of lead oxide chlorides. I. Crystal structures of |
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synthetic mendipite, Pb3O2Cl2, and synthetic damaraite, Pb3O2(OH)Cl |
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_database_code_amcsd 0006899 |
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5.8052 6.9025 15.141 90 90 90 Pmc2_1 |
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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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Pb1 1/2 .7075 .6803 .019 .020 .016 .021 0 0 -.002 |
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Pb2 1/2 .2046 .6265 .018 .020 .015 .019 0 0 .002 |
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Pb3 1/2 .5866 .9144 .022 .019 .033 .014 0 0 -.004 |
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Pb4 0 .5348 .5542 .017 .018 .017 .015 0 0 .001 |
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Pb5 0 .3762 .7804 .018 .019 .023 .014 0 0 .003 |
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Pb6 0 .0737 .4436 .018 .020 .016 .019 0 0 -.001 |
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O1 .2520 .7190 .0018 .017 .015 .023 .013 .001 -.002 .004 |
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O2 .2480 .4600 .6722 .021 .019 .021 .023 -.004 -.007 .004 |
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OH3 0 .7070 .826 .030 .028 .036 .026 0 0 -.014 |
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OH4 1/2 .6640 .5220 .039 .045 .026 .046 0 0 -.017 |
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Cl1 0 -.028 .6531 .026 .021 .033 .024 0 0 .001 |
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Cl2 1/2 -.051 .3516 .042 .056 .041 .030 0 0 .006 |
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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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Damaraite |
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Keller P, Lissner F, Schleid T |
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Neues Jahrbuch fur Mineralogie, Monatshefte 2001 (2001) 326-336 |
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Damaraite, Pb3O2(OH)Cl: crystal structure and new chemical formula |
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Locality: Kombat mine, Namibia |
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_database_code_amcsd 0014912 |
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5.813 6.921 15.192 90 90 90 Pmc2_1 |
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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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Pb1 .5 .41368 .30349 .0194 .0175 .0302 .0104 -.0041 0 0 |
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Pb2 .5 .20455 .09124 .0156 .0187 .0125 .0155 -.0013 0 0 |
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Pb3 .5 .29299 .53775 .0158 .0181 .0126 .0168 -.0015 0 0 |
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Pb4 0 .46542 .66357 .0153 .0179 .015 .0131 .0019 0 0 |
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Pb5 0 .37603 .93753 .0169 .0176 .0214 .0116 -.0036 0 0 |
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Pb6 0 .07363 .27427 .0153 .0184 .0125 .015 .0022 0 0 |
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O1 .2496 .4571 .0425 .0180 .0205 .0126 .0208 -.0045 .0043 -.0011 |
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O2 .2520 .2850 .2123 .0250 .0285 .0307 .0159 .0101 -.0049 -.0012 |
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Oh3 .5 .3328 .6914 .0253 .0472 .0119 .0166 .0009 0 0 |
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Oh4 0 .2951 .3908 .0491 .0674 .0528 .0269 -.0225 0 0 |
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Cl1 0 .0295 .5607 .0306 .0285 .0392 .024 .0049 0 0 |
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Cl2 .5 .0541 .8641 .0366 .0365 .0431 .0301 .0055 0 0 |
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H1 .5 .210 .729 .02 |
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H2 0 .177 .442 .02 |
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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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