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Manganflurlite |
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Kampf A R, Grey I E, MacRae C M, Keck E |
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European Journal of Mineralogy 31 (2019) 127-134 |
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Manganflurlite, ZnMn32+Fe3+(PO4)3(OH)2(H2O)7·2H2O, a new schoonerite-related |
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mineral from the Hagendorf-Sud pegmatite |
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Note: T = 100 K |
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Locality: Hagendorf-Sud pegmatite, Oberpfalz, Bavaria, Germany |
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_database_code_amcsd 0020867 |
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6.3070 11.074 13.085 90 99.62 90 P2_1/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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Zna .58420 .75 .79062 .95 .01539 .0146 .0121 .0177 0 -.00229 0 |
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Znb .5728 .75 .8686 .05 .0247 |
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Mn1 .21349 .25 .83343 .51 .01244 .0116 .0106 .0155 0 .00339 0 |
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Fe1 .21349 .25 .83343 .37 .01244 .0116 .0106 .0155 0 .00339 0 |
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Zn1 .21349 .25 .83343 .10 .01244 .0116 .0106 .0155 0 .00339 0 |
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Mg1 .21349 .25 .83343 .02 .01244 .0116 .0106 .0155 0 .00339 0 |
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Mn2 .24954 .50073 .50888 .51 .01400 .01226 .0162 .01294 -.00071 .00026 .00195 |
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Fe2 .24954 .50073 .50888 .37 .01400 .01226 .0162 .01294 -.00071 .00026 .00195 |
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Zn2 .24954 .50073 .50888 .10 .01400 .01226 .0162 .01294 -.00071 .00026 .00195 |
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Mg2 .24954 .50073 .50888 .02 .01400 .01226 .0162 .01294 -.00071 .00026 .00195 |
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Fe .04594 .75 .62679 .96 .01165 .0069 .0157 .0125 0 .00212 0 |
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Al .04594 .75 .62679 .04 .01165 .0069 .0157 .0125 0 .00212 0 |
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P1 .27813 .53120 .76516 .01152 .0095 .0118 .0132 .0009 .00157 .0013 |
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P2 .52969 .75 .56790 .0099 .0074 .0112 .0110 0 .0014 0 |
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O1 .2120 .43460 .83661 .0167 .0161 .0177 .0167 .0030 .0038 .0012 |
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O2 .3350 .47360 .66607 .0155 .0172 .0137 .0162 .0004 .0045 .0013 |
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O3 .0911 .61938 .73574 .0150 .0095 .0153 .0207 .0035 .0039 .0016 |
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O4 .4747 .59605 .82336 .0179 .0151 .0181 .0187 .0014 -.0021 -.0025 |
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O5 .3595 .75 .63754 .0141 .0089 .0163 .0177 0 .0038 0 |
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O6 .7405 .75 .64689 .0123 .0100 .0127 .0135 0 .0001 0 |
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O7 .5105 .63463 .50212 .0166 .0160 .0171 .0154 -.0056 -.0009 .0024 |
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Oh .0042 .62450 .51614 .0175 .0160 .0173 .0198 -.0046 .0045 -.0021 |
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Ow1 .2298 .52944 .34108 .0164 .0104 .0149 .0226 -.0001 -.0004 -.0003 |
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Ow2 .4431 .25 .9756 .0209 .0189 .0149 .0293 0 .0056 0 |
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Ow3 -.0404 .25 .9234 .0183 .0156 .0147 .0252 0 .0048 0 |
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Ow4 .4568 .25 .7349 .0188 .0233 .0118 .0215 0 .0047 0 |
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Ow5 -.0283 .25 .6900 .0168 .0153 .0169 .0180 0 .0023 0 |
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Ow6 .8717 .75 .8717 .0401 .0151 .095 .0101 0 .0026 0 |
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Ow7 .7229 .44360 .96424 .0212 .0246 .0195 .0180 -.0002 -.0007 .0043 |
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H-OH -.004 .670 .458 .038 |
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H1a .140 .478 .302 .038 |
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H1b .361 .515 .332 .038 |
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H2 .5240 .1848 .982 .038 |
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H3 -.121 .1833 .925 .038 |
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H4 .453 .1836 .6949 .038 |
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H5 -.107 .1841 .695 .038 |
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H6 .957 .75 .824 .038 |
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H7a .662 .493 .915 .038 |
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H7b .780 .486 .019 .038 |
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View JMOL 3-D Structure (permalink) |
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