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Wavellite |
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Araki T, Zoltai T |
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Zeitschrift fur Kristallographie 127 (1968) 21-33 |
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The crystal structure of wavellite |
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Locality: Montgomery County, Arkansas, USA |
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_database_code_amcsd 0010659 |
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9.621 17.3630 6.994 90 90 90 Pcmn |
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atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Al1 .22384 .25 .12326 .684 .00219 .00052 .00316 0 .00070 0 |
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Al2 .75605 .01638 .14186 .371 .00088 .00045 .00124 -.00002 .00039 .00001 |
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P .06061 .09221 .10399 .425 .00139 .00051 .00078 -.00005 -.00027 -.00013 |
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O1 .90525 .08349 .06432 .904 .00282 .00102 .00227 -.00021 -.00143 .00052 |
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O2 .08916 .17642 .15555 1.242 .00323 .00081 .00796 -.00053 .00093 -.00084 |
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O3 .10095 .04183 .27355 1.011 .00272 .00122 .00285 .00001 .00056 .00016 |
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O4 .36037 .07246 .42258 .989 .00358 .00098 .00234 -.00010 .00099 .00081 |
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OH1 .27997 .25 .36925 .777 .00210 .00062 .00415 0 .00102 0 |
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OH2 .82173 .01851 .39490 1.045 .00245 .00099 .00530 -.00024 -.00085 .00020 |
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Wat1 .37060 .17055 .09551 2.237 .00438 .00205 .01337 .00057 -.00106 -.00038 |
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Wat2 .64979 .11144 .19740 1.395 .00457 .00133 .00455 .00074 .00042 .00008 |
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Wat31 .81314 .25 .23453 .5 5.575 .01660 .00239 .03935 0 .00309 0 |
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Wat32 .78308 .25 .11326 .5 4.856 .01644 .00147 .03432 0 .00994 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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Wavellite |
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Capitelli F, Della Ventura G, Bellatreccia F, Sodo A, |
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Saviano M, Ghiara M R, Rossi M |
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Mineralogical Magazine 78 (2014) 1057-1070 |
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Crystal-chemical study of wavellite from Zbirov, Czech Republic |
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Locality: Zbirov, Bohemia, Czech Republic |
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_database_code_amcsd 0020531 |
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9.6422 17.4146 7.0094 90 90 90 Pcmn |
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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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Al1 .22502 .25 .11911 .00974 .0112 .0098 .0082 0 -.0008 0 |
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Al2 .75616 .01635 .14187 .00775 .0082 .0094 .0057 .00003 .00032 .00030 |
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P1 .06085 .09214 .10391 .00734 .0072 .0077 .0071 -.00039 -.00006 -.00049 |
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O1 .90402 .08397 .06528 .0101 .0079 .0130 .0093 -.0011 -.0008 .0021 |
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O2 .09039 .17630 .15711 .0160 .0162 .0109 .0209 -.0036 .0054 -.0054 |
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O3 .10073 .04106 .27381 .0120 .0102 .0169 .0089 .0022 -.0005 .0033 |
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O4 .35920 .07188 .42091 .0107 .0126 .0102 .0092 -.0018 -.0016 .0007 |
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O5 .28790 .25 .3630 .47 .0252 .0256 .0394 .0106 0 -.0047 0 |
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F5 .28790 .25 .3630 .53 .0252 .0256 .0394 .0106 0 -.0047 0 |
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O6 .82065 .01802 .39536 .0109 .0084 .0174 .0068 -.0009 .0004 .0004 |
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O7 .37150 .17066 .0839 .0268 .0210 .0260 .0333 .0054 -.0042 -.0057 |
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O8 .65041 .11101 .19903 .0146 .0162 .0148 .0128 .0036 .0023 .0014 |
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Wat9 .8092 .25 .232 .54 .052 .042 .036 .078 0 .006 0 |
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Wat10 .7813 .25 .110 .56 .058 .067 .028 .078 0 .022 0 |
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H5 .385 .25 .34 .47 .128 |
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H6 .9158 .0287 .390 .046 |
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H71 .383 .139 .193 .15 |
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H72 .368 .153 -.043 .110 |
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H81 .630 .1071 .3296 .048 |
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H82 .705 .1550 .180 .107 |
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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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