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Sejkoraite-(Y) |
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Plasil J, Dusek M, Novak M, Cejka J, Cisarova I, Skoda R |
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American Mineralogist 96 (2011) 983-991 |
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Sejkoraite-(Y), a new member of the zippeite group containing trivalent cations from |
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Jachymov (St. Joachimsthal), Czech Republic: Description and crystal structure refinement |
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Locality: Cervena vein, Jachymov (Street Joachimsthal) ore district, Western Bohemia, Czech Republic |
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_database_code_amcsd 0018390 |
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14.0743 17.4174 17.7062 75.933 128.001 74.419 P-1 |
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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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U1 .50569 .70517 .16924 .0166 .0330 .0195 .0216 -.0186 .0257 -.0153 |
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U2 .49937 .04323 .33362 .0183 .0387 .0208 .0240 -.0216 .0295 -.0172 |
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U3 .48709 .54890 .32956 .0220 .0475 .0254 .0274 -.0271 .0351 -.0201 |
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U4 .51220 .78842 .34152 .0167 .0325 .0195 .0208 -.0182 .0249 -.0145 |
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U5 .50218 .45656 .16629 .0185 .0367 .0205 .0237 -.0200 .0281 -.0164 |
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U6 .42522 .81105 .79490 .0202 .0418 .0234 .0263 -.0230 .0323 -.0185 |
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U7 .46742 .96710 .14252 .0204 .0438 .0246 .0280 -.0259 .0341 -.0206 |
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U8 .57213 .26032 .37918 .0192 .0381 .0246 .0241 -.0226 .0295 -.0184 |
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Y1 .94661 .13274 .11257 .761 .0259 .0305 .0312 .0239 -.0162 .0228 -.0151 |
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Dy1 .94661 .13274 .11257 .239 .0259 .0305 .0312 .0239 -.0162 .0228 -.0151 |
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Y2 .0013 .4481 .8098 .801 .048 .047 .071 .047 -.033 .040 -.037 |
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Y3 .0544 .6227 .3662 .418 .029 .012 .027 .018 -.006 .004 -.004 |
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S1 .5182 .3699 .0075 .015 .028 .011 .017 -.013 .019 -.010 |
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S2 .5083 .1205 .5053 .013 .013 .015 .015 -.009 .010 -.009 |
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S3 .5340 .1131 .0220 .019 .038 .015 .028 -.019 .029 -.018 |
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S4 .4739 .6348 .4857 .024 .054 .022 .033 -.030 .039 -.023 |
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O1 .7588 .1924 .4767 .023 |
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O2 .3186 .1234 .1959 .024 |
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O3 .2996 .6029 .2046 .020 |
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O4 .6722 .4881 .4675 .028 |
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O5 .3215 .5064 .0944 .027 |
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O6 .6796 .4109 .2311 .026 |
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O7 .6928 .6445 .2903 .027 |
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O8 .3911 .3275 .2970 .031 |
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O9 .3149 .7695 .0364 .022 |
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O10 .5891 .0265 .6025 .022 |
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O11 .2845 .0478 .0550 .026 |
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O12 .2426 .8742 .6794 .024 |
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O13 .6017 .7508 .9199 .029 |
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O14 .3883 .6290 .3853 .022 |
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O15 .6497 .8926 .2190 .022 |
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O16 .3253 .8522 .2646 .020 |
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O17 .6994 .7216 .4295 .023 |
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O18 .6252 .2737 .1155 .023 |
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O19 .5642 .5442 .5910 .023 |
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O20 .6771 -.0379 .4730 .022 |
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O21 .6314 .1137 .1251 .025 |
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O22 .6208 .0413 .0253 .023 |
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O23 .5759 .4018 .3405 .017 |
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O24 .5684 .6608 .4890 .023 |
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O25 .6194 .1372 .5261 .022 |
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O26 .4265 .3655 -.0922 .022 |
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O27 .5462 .1577 .3192 .019 |
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O28 .5767 .0436 .2448 .019 |
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O29 .4518 .8382 .1787 .016 |
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O30 .5442 .3096 .2330 .017 |
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O31 .4193 .1278 .3960 .023 |
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O32 .3717 .7079 .4720 .020 |
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O33 .4139 .1906 .4999 .017 |
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O34 .5138 .5687 .2163 .017 |
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O35 .4804 .6827 .2838 .020 |
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O36 .4459 .2062 -.0836 .022 |
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O37 .4349 .0945 .0169 .025 |
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O38 .5043 -.0743 .2929 .019 |
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O39 .6008 .4040 .0023 .023 |
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O40 .4273 .4314 .0110 .022 |
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Wat1 .075 .0190 .4302 .059 |
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Wat2 .8792 .2873 .0812 .057 |
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Wat3 .8817 .1349 .2038 .033 |
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Wat4 .8595 .0572 .0190 .041 |
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Wat5 .112 .317 .140 .126 |
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Wat6 .0605 .8622 .1358 .055 |
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Wat7 .884 .9194 .4089 .084 |
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Wat8 .1416 .1227 .2702 .038 |
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Wat9 .1408 .0439 .1425 .032 |
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Wat10 .0875 -.0297 .2639 .039 |
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Wat11 .9153 .2175 -.0350 .045 |
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Wat12 -.143 .3930 .7186 .094 |
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Wat13 -.149 .4847 .8350 .091 |
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Wat14 -.154 .615 .705 .136 |
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Wat15 .161 .339 .828 .160 |
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Wat16 .134 .506 .819 .137 |
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Wat17 .099 .2938 .961 .124 |
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Wat18 .130 .6792 .503 .112 |
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Wat19 -.130 .715 .320 .130 |
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Wat20 .9124 -.0803 .2614 .055 |
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Wat21 .095 .753 .302 .130 |
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Wat22 -.116 .7579 .651 .123 |
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Wat23 .906 .447 .375 .184 |
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Wat24 .133 .450 .985 .190 |
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Wat25 .077 .777 .633 .174 |
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Wat26 .105 .4894 .378 .119 |
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| Download AMC data (View Text File)
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Franckeite |
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Makovicky E, Petricek V, Dusek M, Topa D |
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American Mineralogist 96 (2011) 1686-1702 |
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The crystal structure of franckeite, Pb21.7Sn9.3Fe4.0Sb8.1S56.9 |
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Locality: San Jose, Bolivia |
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_database_code_amcsd 0018603 |
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5.805 5.856 17.338 94.97 88.45 89.94 C-1 |
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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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Sn1 .25 .25 0 .57 .0259 .0357 .0082 .0344 .0004 .0082 .0005 |
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Fe1 .25 .25 0 .43 .0259 .0357 .0082 .0344 .0004 .0082 .0005 |
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S1 .2882 .6070 .08270 .0468 .090 .0156 .035 .0010 .006 .0007 |
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Pb2 .63901 .97083 -.23153 .74 .0353 .0269 .0301 .0484 -.0008 .0000 .0010 |
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Sn2 .63901 .97083 -.23153 .26 .0353 .0269 .0301 .0484 -.0008 .0000 .0010 |
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Pb3 .17797 .95073 -.41250 .265 .0353 .0300 .0314 .0443 .0077 .0057 .0051 |
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Sn3 .17797 .95073 -.41250 .735 .0353 .0300 .0314 .0443 .0077 .0057 .0051 |
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S2 .1435 .9653 -.2660 .0354 .0207 .0236 .061 .0028 .0043 .0025 |
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S3 .1349 .4239 -.4040 .0556 .058 .074 .033 -.028 .0047 -.005 |
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Zippeite |
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Plasil J, Mills S J, Fejfarova K, Dusek M, Novak M, Skoda R, Cejka J, Sejkora J |
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The Canadian Mineralogist 49 (2011) 1089-1103 |
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The crystal structure of natural zippeite, K1.85H+0.15[(UO2)4O2(SO4)2(OH)2](H2O)4, |
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from Jachymov, Czech Republic |
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Locality: Jachymov, Czech Republic |
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_database_code_amcsd 0018658 |
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8.7802 13.9903 8.8630 90 104.524 90 C2/m |
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atom x y z occ Uiso |
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U .32998 .23438 .32576 .0279 |
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S .5 .2579 0 .023 |
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K1 .118 .5 .353 .24 .063 |
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H1 .118 .5 .353 .04 .063 |
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K2 -.067 .5 -.233 .68 .063 |
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H2 -.067 .5 -.233 .04 .063 |
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O1 .1233 .1800 .096 .031 |
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O2 .435 .1961 .103 .032 |
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O3 .303 .3556 .275 .041 |
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O4 .353 .1107 .363 .039 |
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O5 .102 .2369 .410 .5 .055 |
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OH5 .102 .2369 .410 .5 .055 |
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WatO6a .061 0 .300 .47 .047 |
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WatO6b .074 0 .399 .53 .047 |
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WatO7a .225 .5 -.011 .75 .055 |
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WatO7b .334 .5 .015 .25 .055 |
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Kettnerite |
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Hybler J, Dusek M |
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European Journal of Mineralogy 19 (2007) 411-418 |
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Revision of the crystal structure of kettnerite CaBi[OFCO3] |
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Locality: Krupka, Czech Republic |
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_database_code_amcsd 0007224 |
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5.3641 5.3641 13.5771 90 90 90 Pbaa |
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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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Ca .25 0 .4002 .008 .010 .003 .009 .001 0 0 |
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Bi .25 0 .09429 .0117 .0127 .0124 .0101 .0008 0 0 |
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F .019 .25 .5 .005 |
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C .25 .5 .2555 .016 |
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O1 .003 .25 0 .005 |
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O2 .25 .5 .1609 .021 |
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O3 .383 .344 .2990 .009 |
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Natrite |
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Dusek M, Chapuis G, Meyer M, Petricek V |
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Acta Crystallographica B59 (2003) 337-352 |
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Sodium carbonate revisited |
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Locality: synthetic |
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Sample: Gamma phase, T = 295 K |
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_database_code_amcsd 0009928 |
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8.920 5.245 6.050 90 101.35 90 C2/m |
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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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Na1 0 0 0 .01731 .01757 .01860 .01713 0 .00672 0 |
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Na2 0 0 .5 .01673 .01919 .01561 .01686 0 .00714 0 |
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Na3 .17055 .5 .74801 .02554 .02174 .02568 .0307 0 .00888 0 |
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C .16446 .5 .24914 .01155 .0111 .01219 .0119 0 .0037 0 |
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O1 .10159 .29384 .28535 .02607 .0318 .01881 .0299 -.00956 .01172 .00055 |
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O2 .28987 .5 .17757 .02274 .0148 .0324 .0237 0 .0104 0 |
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Natrite |
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Dusek M, Chapuis G, Meyer M, Petricek V |
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Acta Crystallographica B59 (2003) 337-352 |
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Sodium carbonate revisited |
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Locality: synthetic |
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Sample: Delta phase, T = 110 K |
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_database_code_amcsd 0009929 |
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8.898 5.237 5.996 90 101.87 90 C2/m |
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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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Na1 0 0 0 .00886 .00927 .00910 .00885 0 .00338 0 |
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Na2 0 0 .5 .00855 .01018 .00779 .00831 0 .00332 0 |
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Na3 .17125 .5 .74784 .01267 .01204 .01238 .01448 0 .00482 0 |
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C .16454 .5 .24887 .00695 .0071 .00690 .0072 0 .00232 0 |
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O1 .10175 .29345 .28667 .01312 .01620 .00969 .01463 -.00452 .00584 .00021 |
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O2 .28941 .5 .17472 .01135 .00874 .01506 .0115 0 .00509 0 |
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Gustavite |
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Pazout R, Dusek M |
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Acta Crystallographica C65 (2009) i77-i80 |
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Natural monoclinic AgPb(Bi2Sb)S6, an Sb-rich gustavite, |
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Locality: Kutna Hora polymetallic deposit, Czech Republic |
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_database_code_amcsd 0017602 |
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7.0455 19.5294 8.3412 90 107.446 90 P2_1/c |
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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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Ag1b .8571 .36619 .2141 .0493 .058 .0400 .0456 -.0217 .0090 -.0017 |
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Pb3 .36678 .24985 .34306 .0350 .0334 .0416 .0301 -.0021 .0096 -.0006 |
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Bi1a .82041 .13967 .20339 .909 .0238 .0225 .0244 .0246 -.0011 .0073 .0006 |
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Bi2b .26197 .45056 .06313 .739 .0242 .0272 .0213 .0229 .0000 .0055 -.0002 |
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Sb2b .26197 .45056 .06313 .261 .0242 .0272 .0213 .0229 .0000 .0055 -.0002 |
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Sb2a .2793 .05451 .07319 .650 .0219 .0168 .0258 .0224 .0023 .0049 -.0008 |
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Bi2a .2793 .05451 .07319 .350 .0219 .0168 .0258 .0224 .0023 .0049 -.0008 |
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S3 .6512 .2599 .1642 .025 .025 .029 .023 -.001 .009 -.001 |
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S4b .0924 .3331 .0084 .026 .030 .021 .028 .003 .010 .000 |
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S1a .5016 .4015 .3948 .029 .015 .031 .041 -.006 .009 .003 |
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S4a .0838 .1658 .0293 .025 .026 .020 .029 .007 .012 .006 |
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S1b .5089 .0969 .3582 .027 .011 .034 .034 -.006 .003 .005 |
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S2 .9871 .4915 .2228 .030 .030 .030 .032 .010 .013 .001 |
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NaMg(H2PO3)3*H2O |
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Ouarsal R, Tahiri A A, Lachkar M, Dusek M, Fejfarova K, El Bali B |
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Acta Crystallographica E59 (2003) i33-i35 |
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Sodium magnesium tris(dihydrogenphosphite) monohydrate, NaMg(H2PO3)3*H2O |
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_database_code_amcsd 0010399 |
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14.8060 9.078 14.811 90 90 90 Pbca |
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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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Na1 .93245 .06142 .15732 .0264 .0296 .0227 .0267 -.0072 -.0136 .0078 |
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Mg1 .95397 .44768 .16036 .01237 .0125 .0121 .0125 -.0001 -.0012 -.0003 |
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P1 .88097 .73759 .27655 .01290 .0114 .0125 .0148 -.00014 .0011 -.00160 |
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P2 .73601 -.03858 .03132 .01396 .0113 .0151 .0154 -.00106 .00093 -.0009 |
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P3 .99216 .27043 -.03020 .01409 .0168 .0124 .0131 -.00101 .0023 -.0008 |
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O1 .83022 .01936 .04050 .0219 .0133 .0309 .0214 -.0052 .0002 .0017 |
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O2 .67081 .01163 .10360 .0206 .0162 .0228 .0228 -.0016 .0063 -.0041 |
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O3 .93078 .88124 .27105 .0171 .0169 .0139 .0206 -.0016 -.0040 .0010 |
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O4 .97033 .40461 -.08581 .0194 .0197 .0210 .0175 .0001 .0018 .0068 |
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O5 .80042 .74139 .20597 .0243 .0158 .0230 .0340 .0058 -.0102 -.0110 |
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O6 .97054 .27935 .06863 .0191 .0303 .0149 .0121 -.0022 -.0006 .0004 |
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O7 .88190 .2877 .23950 .0211 .0146 .0288 .0199 -.0040 -.0009 .0034 |
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O8 .93482 .59990 .26106 .0173 .0187 .0153 .0178 .0034 -.0048 -.0036 |
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O9 .70170 .0047 -.06526 .0315 .0207 .0536 .0202 -.0060 -.0051 .0069 |
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O10 .94366 .1322 -.07248 .0339 .0546 .0291 .0179 -.0240 .0122 -.0089 |
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H1 .832 .289 .235 .047 |
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H2 .7366 -.177 .0279 .020 |
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H3 .8411 .726 .3515 .014 |
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H4 .912 .093 -.039 .067 |
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H5 .651 -.007 -.074 .051 |
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H6 .0773 .244 -.0395 .019 |
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H7 .895 .300 .296 .041 |
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H8 .807 .660 .171 .052 |
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K2Co(HPO3)2*2H2O |
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Ouarsal R, Essehli R, Lachkar M, Zenkouar M, Dusek M, Fejfarova K, El Bali B |
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Acta Crystallographica E60 (2004) i66-i68 |
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Dipotassium cobalt(II) bis(hydrogenphosphite) dihydrate, K2Co(HPO3)2*2H2O |
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_database_code_amcsd 0010429 |
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12.538 5.319 7.327 90 116.02 90 C2/m |
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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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K .33740 .5 .71451 .0231 .0192 .0290 .0213 0 .0090 0 |
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Co .5 0 .5 .0148 .0155 .0124 .0170 0 .0076 0 |
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P .35035 .5 .25574 .0153 .0132 .0145 .0162 0 .0045 0 |
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O1 .4207 .5 .1329 .0255 .0265 .0327 .0201 0 .0128 0 |
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O2 .5159 0 .2161 .0276 .0283 .0338 .0219 0 .0120 0 |
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O3 .36625 .2659 .3831 .0214 .0217 .0141 .0294 .0024 .0120 .0043 |
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H1 .238 .5 .110 .014 |
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H2 .481 -.136 .160 .03 |
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Pyrargyrite |
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Laufek F, Sejkora J, Dusek M |
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Journal of Geosciences 55 (2010) 161-167 |
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The role of silver in the crystal structure of pyrargyrite: single |
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crystal X-ray diffraction study |
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Locality: H61Z vein, Haje ore deposit, Pribram distict, Czech Republic |
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_database_code_amcsd 0013027 |
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11.0464 11.0464 8.7211 90 90 120 R3c |
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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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Sb 0 0 0 .0197 .0207 .0207 .0178 .0103 0 0 |
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Ag .2469 .3031 .2184 .0727 .0986 .0520 .0677 .0378 .0020 .0310 |
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S .2215 .1007 .3609 .0233 .0188 .0213 .0281 .0089 .0016 .0010 |
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Behounekite |
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Plasil J, Fejfarova K, Novak M, Dusek M, Skoda R, Hlousek J, Cejka J, |
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Majzlan J, Sejkora J, Machovic V, Talla D |
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Mineralogical Magazine 75 (2011) 2739-2753 |
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Behounekite, U(SO4)2(H2O)4, From Jachymov (St Joachimsthal), Czech Republic: |
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the first natural U4+ sulphate |
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Locality: Jachymov, Czech Republic |
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_database_code_amcsd 0018561 |
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14.6464 11.0786 5.6910 90 90 90 Pnma |
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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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U .82892 .75 .12581 .0096 .0101 .0075 .0111 0 .00037 0 |
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S .8508 .4451 .3856 .0094 .0080 .0070 .0132 .0003 .0008 .0001 |
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O1 .9760 .75 .308 .020 .014 .011 .034 0 .015 0 |
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O2 .9244 .6247 .1104 .021 .012 .018 .033 .003 .0059 .0129 |
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O3 .8323 .5757 .3520 .019 .025 .010 .021 .0019 .0011 .0002 |
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O4 .9065 .4297 .5943 .017 .022 .010 .019 .0022 .0094 .0010 |
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O5 .7611 .3839 .4165 .018 .014 .020 .019 .010 .0059 .0035 |
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O6 .8949 .3968 .1751 .019 .0140 .021 .023 .0026 .0090 .0112 |
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O7 .7033 .75 .3837 .021 .022 .015 .026 0 .018 0 |
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H1 .701 .6896 .467 .025284 |
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H2 .912 .568 .199 .025264 |
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H3 .977 .644 .130 .025264 |
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H5 1.005 .6892 .347 .023617 |
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Weeksite |
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Fejfarova K, Plasil J, Yang H, Cejka J, Dusek M, Downs R T, Barkley M C, Skoda R |
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American Mineralogist 97 (2012) 750-754 |
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Revision of the crystal structure and chemical formula of weeksite, |
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K2(UO2)2(Si5O13)*4H2O |
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Locality: Anderson mine, Arizona, USA |
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_database_code_amcsd 0018760 |
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14.1957 14.2291 9.6305 90 111.578 90 C2/m |
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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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U1 .099331 .246786 .89678 .01189 .00807 .01867 .00959 .00057 .00403 .00072 |
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K1 -.0707 0 .8602 .951 .0369 .0280 .0310 .057 0 .0224 0 |
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K2 .2460 0 .8433 .930 .054 .058 .040 .089 0 .055 0 |
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Si1 0 .3068 .5 .0166 .0133 .0244 .0121 0 .0046 0 |
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Si2 .18748 .24984 .2495 .0116 .0094 .0180 .0080 .0011 .0038 -.0010 |
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Si3 .29855 .10998 .5004 .0184 .0220 .0156 .0192 -.0011 .0095 .0000 |
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O1 .4105 .1224 .4996 .033 .020 .030 .052 -.005 .018 -.002 |
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O2 .0712 .2440 .1370 .023 .006 .055 .007 .000 .001 -.001 |
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O3 .2472 .2551 .1367 .024 .009 .055 .009 .000 .005 -.001 |
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O4 .0366 .2437 .6473 .023 .024 .037 .008 .003 .006 .006 |
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O5 .2162 .1560 .3546 .027 .028 .026 .021 -.001 .002 .011 |
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O6 .2705 0 .4998 .022 .029 .012 .029 0 .013 0 |
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O7 .2892 .1573 .6467 .026 .036 .018 .027 -.003 .016 -.007 |
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O8 .1020 .1201 .9055 .029 .035 .019 .040 -.001 .021 .001 |
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O9 .0990 .3727 .8972 .032 .036 .020 .042 -.003 .016 -.003 |
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Wat10 .4310 0 .8411 .053 .033 .040 .073 0 .005 0 |
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Wat11 -.2624 0 .8441 .98 .059 .059 .052 .073 0 .034 0 |
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Wat12 0 0 .5 .72 .036 |
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Wat13 0 -.079 .5 .259 .036 |
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Wat14 -.0464 -.0614 .602 .281 .036 |
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Wat15 -.0917 -.0636 .398 .264 .036 |
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Wat16 -.445 0 .702 .24 .024 |
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View JMOL 3-D Structure
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Adolfpateraite |
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Plasil J, Hlousek J, Veselovsky F, Fejfarova K, Dusek M, |
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Skoda R, Novak M, Cejka J, Sejkora J, Ondrus P |
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American Mineralogist 97 (2012) 447-454 |
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Adolfpateraite, K(UO2)(SO4)(OH)(H2O), a new uranyl, |
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sulphate mineral from Jachymov, Czech Republic |
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Locality: Jachymov, Czech Republic |
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_database_code_amcsd 0018778 |
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8.0462 7.9256 11.3206 90 107.726 90 P2_1/c |
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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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K .0606 .5351 .29766 .0210 .0175 .0202 .0248 .0014 .0057 .0021 |
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U .57544 .39873 .29873 .01234 .01067 .01020 .01605 -.00011 .00391 -.00059 |
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S .2038 .2656 .03944 .0137 .0136 .0122 .0141 .0009 .0024 .0006 |
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O1 .2158 .0791 .0607 .0193 .0185 .0127 .0226 -.0001 .0001 .0014 |
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O2 .4336 .1436 .3097 .016 .0165 .0133 .0186 -.0007 .0071 -.0020 |
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O3 .1482 .2038 .4062 .0210 .0225 .0228 .0152 -.0007 .0017 -.0031 |
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O4 .7482 .3253 .2440 .0195 .0185 .0175 .0246 .0017 .0095 -.0051 |
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O5 .4108 .4851 .3545 .0195 .0164 .0184 .0257 .0008 .0093 -.0020 |
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O6 .3786 .3421 .0946 .022 .0212 .0200 .0195 -.0091 -.0001 .0007 |
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O7 .0797 .3332 .0974 .0256 .0239 .0283 .0264 .0050 .0102 -.0034 |
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O8 .2654 .7336 .0135 .0289 .0211 .0329 .0280 .0038 .0004 -.0125 |
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H2a .359 .137 .335 .022 |
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H8a .159 .695 .002 .0347 |
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H8b .325 .645 .008 .0347 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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Grimselite |
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Plasil J, Fejfarova K, Skala R, Skoda R, Meisser N, Hlousek J, Cisarova I, |
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Dusek M, Veselovsky F, Cejka J, Sejkora J, Ondrus P |
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Mineralogical Magazine 76 (2012) 443-453 |
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The crystal chemistry of the uranyl carbonate mineral grimselite, |
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(K,Na)3Na[(UO2)(CO3)3](H2O), from Jachymov, Czech Republic |
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Note: Sample A |
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Locality: Jachymov, Czech Republic |
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_database_code_amcsd 0018908 |
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9.2507 9.2507 8.1788 90 90 120 P-62c |
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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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K1 .2897 0 0 .821 .0355 .0420 .0335 .0282 .0168 .0047 .0095 |
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Na1 .2897 0 0 .179 .0355 .0420 .0335 .0282 .0168 .0047 .0095 |
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Na2 1/3 2/3 .75 .0283 .0347 .0347 .0154 .0173 0 0 |
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U 2/3 1/3 .75 .01364 .01371 .01371 .01350 0 .00685 0 |
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C .9887 .6296 .75 .024 .019 .021 .032 .010 0 0 |
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O1 .9697 .4800 .75 .0282 .0154 .021 .0499 .011 0 0 |
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O2 .8497 .6324 .75 .0314 .022 .025 .050 .0138 0 0 |
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O3 2/3 1/3 .9686 .0352 .0451 .0451 .0155 .0226 0 0 |
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O4 .1293 .7588 .75 .0341 .0208 .022 .051 .0045 0 0 |
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Wat5 0 0 .122 .5 .090 .093 .093 .084 .046 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
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Grimselite |
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Plasil J, Fejfarova K, Skala R, Skoda R, Meisser N, Hlousek J, Cisarova I, |
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Dusek M, Veselovsky F, Cejka J, Sejkora J, Ondrus P |
| |
Mineralogical Magazine 76 (2012) 443-453 |
|
The crystal chemistry of the uranyl carbonate mineral grimselite, |
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(K,Na)3Na[(UO2)(CO3)3](H2O), from Jachymov, Czech Republic |
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Note: Sample B |
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Locality: Jachymov, Czech Republic |
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_database_code_amcsd 0018909 |
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9.3000 9.3000 8.2940 90 90 120 P-62c |
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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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K .2922 0 0 .0368 .0420 .036 .031 .0178 .0043 .009 |
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Na 1/3 2/3 .75 .027 .029 .029 .022 .0143 0 0 |
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U 2/3 1/3 .75 .0165 .0149 .0149 .0197 .0075 0 0 |
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C .989 .632 .75 .022 .021 .016 .028 .009 0 0 |
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O1 .9677 .478 .75 .026 .010 .020 .048 .008 0 0 |
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O2 .8475 .6299 .75 .023 .018 .036 .035 .017 0 0 |
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O3 2/3 1/3 .965 .031 .030 .030 .034 .015 0 0 |
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O4 .1281 .759 .75 .026 .023 .024 .050 .008 0 0 |
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Wat5 0 0 .130 .5 .071 .083 .083 .05 .04 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
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