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Ammineite |
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Bojar H P, Walter F, Baumgartner J, Farber G |
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The Canadian Mineralogist 48 (2010) 1359-1371 |
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Ammineite, CuCl2(NH3)2, a new species containing an ammine complex: |
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Mineral data and crystal structure |
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Locality: Calleta Pabellon de Pica, Tarapaca region, Chile |
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_database_code_amcsd 0018300 |
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7.688 10.645 5.736 90 90 90 Cmcm |
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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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Cu .5 .38685 .25 .0115 .0098 .0115 .0131 0 0 0 |
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Cl1 .5 .16546 .25 .0122 .0136 .0106 .0125 0 0 0 |
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Cl2 .5 .60817 .25 .0122 .0153 .0102 .0111 0 0 0 |
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N .2445 .3871 .25 .0124 .0143 .0151 .0079 .0001 0 0 |
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H1 .210 .452 .25 .05 |
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H2 .202 .356 .131 .05 |
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Klochite |
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Bojar H P, Walter F, Hauzenberger C, Postl W |
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The Canadian Mineralogist 49 (2011) 1115-1124 |
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Klochite, K_2(Fe2+Fe3+)Zn3[Si12O30], a new milarite-type mineral species |
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from the Kloch volcano, Styria, Austria |
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Locality: Kloch volcano, Bad Radkersburg district, Styria, Austria |
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_database_code_amcsd 0018643 |
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10.120 10.120 14.298 90 90 120 P6/mcc |
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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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KC 0 0 .25 .81 .013 .014 .014 .010 .0069 0 0 |
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NaC 0 0 .25 .19 .013 .014 .014 .010 .0069 0 0 |
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NaB 1/3 2/3 0 .08 .03 |
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FeA 1/3 2/3 .25 .87 .0063 .0071 .0071 .0047 .0035 0 0 |
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MnA 1/3 2/3 .25 .13 .0063 .0071 .0071 .0047 .0035 0 0 |
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ZnT2 .5 0 .25 .93 .0081 .0096 .0074 .0064 .0037 0 0 |
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SiT1 .11653 .35251 .10978 .0079 .0084 .0107 .0048 .0049 -.0003 -.0006 |
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O1 .1303 .3911 0 .0135 .016 .020 .005 .009 0 0 |
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O2 .2211 .2773 .1354 .0146 .018 .020 .0103 .0135 -.0017 -.0011 |
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O3 .1586 .4993 .1720 .0103 .0119 .0116 .0081 .0063 .0001 -.0005 |
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Trattnerite |
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Postl W, Walter F, Ettinger K, Hauzenberger C, Bojar H P |
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European Journal of Mineralogy 16 (2004) 375-380 |
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Trattnerite, (Fe,Mg)2(Mg,Fe)3[Si12O30], a new mineral of the milarite group: |
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mineral data and crystal structure |
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Sample: tr1 |
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Note: X-coordinate of A site adjusted to match reported bond lengths and Figure 3 |
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_database_code_amcsd 0007066 |
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10.050 10.050 14.338 90 90 120 P6/mcc |
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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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KC 0 0 .25 .05 .02 |
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FeA 1/3 2/3 .25 .65 .0079 .0079 .0071 .0040 0 0 |
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MgA 1/3 2/3 .25 .35 .0079 .0079 .0071 .0040 0 0 |
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Mg2 .5 .5 .25 .62 .0185 .0185 .0102 .0153 0 0 |
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Fe2 .5 .5 .25 .38 .0185 .0185 .0102 .0153 0 0 |
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Si1 .1184 .3554 .1085 .0092 .0105 .0082 .0050 -.0002 -.0008 |
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O1 .1345 .4019 0 .021 .018 .012 .008 0 0 |
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O2 .2277 .2848 .1318 .017 .021 .022 .014 .001 .001 |
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O3 .1588 .5004 .1739 .014 .014 .013 .0072 -.0011 -.0034 |
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Trattnerite |
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Postl W, Walter F, Ettinger K, Hauzenberger C, Bojar H P |
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European Journal of Mineralogy 16 (2004) 375-380 |
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Trattnerite, (Fe,Mg)2(Mg,Fe)3[Si12O30], a new mineral of the milarite group: |
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mineral data and crystal structure |
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Sample: tr2 |
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Note: X-coordinate of A site adjusted to match reported bond lengths and Figure 3 |
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_database_code_amcsd 0007067 |
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10.065 10.065 14.341 90 90 120 P6/mcc |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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KC 0 0 .25 .12 .019 .019 .015 .009 0 0 |
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FeA 1/3 2/3 .25 .62 .0075 .0075 .0065 .0038 0 0 |
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MgA 1/3 2/3 .25 .38 .0075 .0075 .0065 .0038 0 0 |
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Mg2 .5 .5 .25 .59 .0145 .0145 .0081 .0104 0 0 |
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Fe2 .5 .5 .25 .41 .0145 .0145 .0081 .0104 0 0 |
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Si1 .11856 .35553 .10866 .0101 .0108 .0071 .0052 -.0000 -.0005 |
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O1 .1339 .4009 0 .016 .015 .010 .007 0 0 |
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O2 .2273 .2842 .1323 .0163 .0170 .0155 .0105 .0007 .0002 |
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O3 .1595 .5012 .1737 .0139 .0133 .0104 .0077 -.0015 -.0025 |
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Fluoro-magnesiohastingsite |
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Bojar H P, Walter F |
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European Journal of Mineralogy 18 (2006) 503-508 |
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Fluoro-magnesiohastingsite from Dealul Uroi (Hunedoara county, Romania): |
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Mineral data and crystal structure of a new amphibole end-member |
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Locality: Dealul Uroi, Hunedoara county, Romania |
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_database_code_amcsd 0007162 |
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9.871 18.006 5.314 90 105.37 90 C2/m |
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atom x y z occ Uiso |
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NaAm 0 .4819 0 .095 .017 |
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KAm 0 .4819 0 .04 .017 |
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CaAm 0 .4819 0 .035 .017 |
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NaA2 .0500 .5 .1032 .16 .024 |
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KA2 .0500 .5 .1032 .065 .024 |
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CaA2 .0500 .5 .1032 .06 .024 |
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CaM4 0 .2794 .5 .0073 |
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MgM1 0 .0871 .5 .885 .0073 |
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TiM1 0 .0871 .5 .045 .0073 |
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AlM1 0 .0871 .5 .04 .0073 |
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Fe2+M1 0 .0871 .5 .03 .0073 |
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MgM2 0 .1754 0 .69 .0068 |
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Fe3+M2 0 .1754 0 .31 .0068 |
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MgM3 0 0 0 .88 .0067 |
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AlM3 0 0 0 .05 .0067 |
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TiM3 0 0 0 .04 .0067 |
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Fe2+M3 0 0 0 .03 .0067 |
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SiT1 .2822 .0852 .3053 .525 .0059 |
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AlT1 .2822 .0852 .3053 .475 .0059 |
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SiT2 .2914 .1730 .8143 .96 .0056 |
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AlT2 .2914 .1730 .8143 .04 .0056 |
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O1 .1074 .0865 .2197 .0069 |
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O2 .1191 .1715 .7318 .0076 |
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F3 .1049 0 .7130 .0127 |
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O4 .3660 .2510 .7885 .0086 |
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O5 .3520 .1404 .1145 .0101 |
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O6 .3470 .1167 .6132 .0106 |
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O7 .3451 0 .2807 .0155 |
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Struvite-K |
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Graeser S, Postl W, Bojar H P, Berlepsch P, Armbruster T, Raber T, Ettinger K, Walter F |
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European Journal of Mineralogy 20 (2008) 629-633 |
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Struvite-(K), KMgPO4*6H2O, the potassium equivalent of struvite - a new mineral |
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Locality: Lengenbach, Switzerland |
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_database_code_amcsd 0007262 |
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6.892 6.166 11.139 90 90 90 Pmn2_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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K 0 .3662 .0032 .0586 .069 .0497 .057 0 0 .0120 |
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Mg 0 .3825 .6492 .0201 .0220 .0169 .0215 0 0 .0018 |
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P 0 -.0073 .2756 .0169 .0184 .0148 .0174 0 0 -.0007 |
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O1 0 -.0214 .1381 .0275 .029 .028 .026 0 0 .003 |
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O2 0 -.2381 .3293 .0272 .035 .018 .028 0 0 .006 |
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O3 .1820 .1109 .3186 .0239 .0228 .0218 .027 -.0017 .002 -.003 |
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O4 1/2 .3104 .0627 .049 .097 .021 .029 0 0 0 |
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O5 1/2 .9147 .2409 .042 .020 .036 .071 0 0 -.031 |
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O6 .2209 .2690 .5387 .0309 .027 .048 .018 .007 .001 -.005 |
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O7 .2892 .5110 .2642 .0400 .041 .023 .056 .005 .024 .013 |
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H41 1/2 .300 -.016 .037 |
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H42 1/2 .256 .134 .037 |
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H51 .391 .985 .251 .037 |
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H61 .195 .251 .467 .037 |
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H62 .303 .196 .584 .037 |
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H71 .238 .401 .278 .037 |
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H72 .186 .578 .290 .037 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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