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Mrazekite |
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Ridkosil T, Srein V, Fabry J, Hybler J, Maximov B A |
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The Canadian Mineralogist 30 (1992) 215-224 |
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Mrazekite, Bi2Cu3(OH)2O2(PO4)2.2H2O, a new mineral species |
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and its crystal structure |
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_database_code_amcsd 0005275 |
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12.359 6.331 9.060 90 122.71 90 C2/m |
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atom x y z Biso |
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Bi .1595 0 .0907 1.54 |
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Cu1 0 .5 0 1.2 |
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Cu2 .25 .25 .5 1.75 |
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P .3061 .5 .2522 1.1 |
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O1 .1639 0 .3607 1.9 |
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OH2 .0856 0 -.2146 2.0 |
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O3 .1805 .5 .0691 2.2 |
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O4 0 .2070 0 2.2 |
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O5 .3153 .3028 .3526 3.3 |
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Wat6 .0366 .5 .3248 3.1 |
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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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Mrazekite |
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Effenberger H, Krause W, Belendorff K, Bernhardt H J, Medenbach O, Hybler J, Petricek V |
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The Canadian Mineralogist 32 (1994) 365-372 |
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Revision of the crystal structure of mrazekite, Bi2Cu3(OH)2O2(PO4)2.2H2O |
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_database_code_amcsd 0005364 |
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9.065 6.340 21.239 90 101.57 90 P2_1/n |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Bi1 .36464 .25135 .04570 .0185 .0160 .0155 .0003 .0034 .0002 |
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Bi2 .38662 .19971 .20523 .0173 .0161 .0147 .0000 .0031 .0000 |
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Cu1 0 0 0 .0171 .0173 .0248 -.0016 .0037 -.0001 |
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Cu2 0 .5 0 .0174 .0167 .0248 .0023 .0039 .0007 |
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Cu3 .3719 .7251 .1251 .0276 .0134 .0151 .0000 .0035 .0002 |
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Cu4 .7461 .4532 .2469 .0171 .0188 .0247 -.0024 .0041 .0001 |
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P1 .7237 .2688 .0281 .0178 .0164 .0166 .0007 .0042 .0004 |
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P2 .0284 .2192 .2226 .0181 .0160 .0147 -.0001 .0042 .0001 |
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O11 .631 .247 .0803 .020 .036 .028 .002 .007 .0000 |
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O12 .809 .064 .0224 .026 .015 .037 -.002 .006 .0000 |
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O13 .610 .315 -.0345 .030 .033 .014 -.006 .004 -.003 |
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O14 .832 .460 .0417 .022 .022 .031 .000 .005 .000 |
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O21 .115 .189 .1690 .012 .027 .017 -.002 .001 .000 |
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O22 -.056 .013 .2299 .020 .020 .033 .000 .006 -.002 |
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O23 -.081 .407 .2086 .022 .022 .039 .000 .009 .002 |
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O24 .147 .267 .2847 .023 .032 .019 .001 .005 -.001 |
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Oo1 .378 .025 .1200 .023 .018 .019 .004 .004 .003 |
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Oo2 .372 .425 .1307 .022 .014 .020 .002 .005 .000 |
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OH1 .652 .195 .2068 .024 .020 .019 -.001 .005 .000 |
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OH2 .099 .254 .0436 .018 .018 .026 .002 .003 .002 |
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Wat1 .065 .769 .1050 .034 .052 .026 -.008 .004 -.001 |
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Wat2 .685 .735 .1403 .064 .065 .021 -.012 -.002 .000 |
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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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