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Giacovazzoite |
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Biagioni C, Bindi L, Mauro D, Pasero M |
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Physics and Chemistry of Minerals 47 (2020) 7 |
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Crystal-chemistry of sulfates from the Apuan Alps (Tuscany, Italy). |
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IV. Giacovazzoite, K5Fe3+3O(SO4)6(H2O)9*H2O, the natural analogue of the �-Maus's salt |
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and its dehydration product |
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Note: T = 100 K |
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Locality: the Monte Arsiccio mine, Apuan Alps, Tuscany, Italy |
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_database_code_amcsd 0020910 |
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9.4480 18.3183 17.9825 90 92.274 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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K1 .54415 .15573 .24416 .01300 .0140 .0119 .0130 -.0008 -.0005 -.0003 |
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K2 .63785 .22595 .03564 .01687 .0195 .0104 .0202 -.0009 -.0054 .0010 |
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K3 .26611 .10184 .04798 .01583 .0197 .0110 .0167 -.0018 -.0005 -.0025 |
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K4 .12505 .20433 .27235 .01689 .0143 .0103 .0258 .0028 -.0028 .0006 |
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K5 .32617 .11271 .44081 .01598 .0211 .0116 .0153 .0010 .0016 .0021 |
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Fe1 .31621 .41663 .25801 .00789 .0090 .00540 .00925 .00017 -.00064 -.00021 |
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Fe2 .63609 .40773 .34320 .00819 .0090 .00558 .00984 .00021 -.00081 .00020 |
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Fe3 .59944 .39646 .15778 .00847 .0094 .00609 .00986 .00054 -.00017 -.00016 |
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S1 .39126 .52165 .39297 .00851 .0098 .0056 .0100 .0002 -.0005 -.0008 |
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S2 .39806 .29491 .38371 .00901 .0104 .0058 .0107 -.0004 -.0006 .0011 |
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S3 .78161 .52346 .24106 .00932 .0101 .0058 .0120 -.0006 -.0003 .0002 |
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S4 .81673 .29379 .24349 .00920 .0094 .0061 .0120 .0007 -.0003 .0003 |
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S5 .36450 .51371 .10715 .00941 .0118 .0066 .0098 .0011 -.0011 .0004 |
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S6 .31440 .29483 .12870 .00908 .0100 .0061 .0109 .0006 -.0019 -.0014 |
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O1 .3331 .51081 .31504 .0106 .0128 .0083 .0106 .0011 -.0018 -.0017 |
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O2 .5094 .46856 .40712 .0120 .0126 .0109 .0124 .0015 -.0011 -.0007 |
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O3 .2797 .50662 .44520 .0124 .0149 .0094 .0131 -.0007 .0009 -.0011 |
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O4 .4442 .59605 .40020 .0133 .0159 .0077 .0160 -.0029 -.0019 -.0007 |
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O5 .3076 .35512 .35081 .0108 .0127 .0081 .0116 .0025 .0005 .0010 |
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O6 .5500 .31631 .37780 .0136 .0095 .0098 .0215 .0000 -.0003 .0061 |
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O7 .3680 .28700 .46209 .0145 .0183 .0140 .0114 .0000 .0005 .0037 |
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O8 .3743 .22766 .34214 .0146 .0191 .0062 .0181 .0001 -.0037 -.0019 |
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O9 .7352 .50089 .31633 .0124 .0180 .0078 .0116 -.0034 .0023 -.0003 |
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O10 .7679 .45952 .18991 .0104 .0111 .0068 .0131 -.0005 -.0005 -.0016 |
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O11 .9320 .54472 .24815 .0122 .0117 .0085 .0163 -.0014 -.0010 .0002 |
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O12 .6962 .58470 .21386 .0128 .0142 .0067 .0172 .0011 -.0028 .0003 |
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O13 .7938 .34690 .30513 .0128 .0121 .0127 .0136 .0024 .0006 -.0033 |
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O14 .6979 .30248 .18645 .0119 .0119 .0084 .0152 .0017 -.0021 -.0005 |
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O15 .9524 .31061 .21054 .0126 .0105 .0096 .0178 .0005 .0012 -.0006 |
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O16 .8143 .21918 .27127 .0140 .0165 .0059 .0194 -.0004 -.0012 .0032 |
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O17 .5112 .48214 .10742 .0134 .0127 .0136 .0142 .0025 .0027 .0056 |
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O18 .2841 .47660 .16563 .0130 .0122 .0144 .0124 .0006 .0005 .0012 |
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O19 .2937 .50093 .03541 .0132 .0170 .0114 .0109 -.0024 -.0022 .0004 |
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O20 .3787 .59139 .12256 .0165 .0227 .0073 .0193 .0000 -.0025 -.0014 |
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O21 .4500 .33140 .10840 .0146 .0116 .0181 .0142 -.0031 .0020 -.0050 |
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O22 .2710 .32571 .20116 .0115 .0134 .0091 .0123 -.0026 .0016 -.0038 |
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O23 .2070 .31122 .07069 .0140 .0131 .0139 .0147 .0031 -.0039 -.0019 |
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O24 .3376 .21723 .13912 .0176 .0297 .0078 .0151 .0030 -.0022 -.0014 |
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O25 .5174 .40817 .25241 .0097 .0102 .0091 .0097 .0014 -.0016 .0007 |
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OW26 .0990 .42464 .27070 .0113 .0092 .0085 .0161 .0006 -.0004 -.0008 |
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OW27 .7620 .40300 .43961 .0130 .0140 .0114 .0133 .0018 -.0023 -.0024 |
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OW28 .7038 .38409 .05968 .0127 .0138 .0127 .0117 .0010 .0012 .0016 |
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OW29 -.0024 .0701 .1013 .0388 .031 .053 .0310 -.0108 -.0090 .0135 |
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OW30 .9195 .2133 .0743 .0414 .038 .037 .048 .0012 -.0072 -.0034 |
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OW31 .9775 .40551 .05600 .0163 .0126 .0151 .0212 .0018 .0008 .0031 |
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OW32 .9556 .55378 .08561 .0210 .0245 .0181 .0208 .0013 .0054 -.0002 |
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OW33 .9251 .72919 .07272 .0196 .0172 .0197 .0219 .0009 -.0009 -.0006 |
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OW34 .9614 .88056 .06621 .0172 .0156 .0149 .0214 -.0024 .0043 -.0046 |
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OW35 .7890 .20698 .42857 .0180 .0186 .0176 .0177 -.0043 -.0016 .0050 |
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H261 .049 .387 .246 .05 |
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H262 .057 .463 .244 .06 |
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H271 .751 .438 .478 .07 |
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H272 .861 .403 .433 .05 |
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H281 .804 .384 .059 .022 |
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H282 .717 .427 .032 .06 |
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H291 -.009 .065 .1543 .06 |
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H292 -.088 .052 .075 .08 |
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H311 .055 .381 .076 .015 |
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H321 .024 .565 .051 .06 |
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H322 .023 .564 .124 .027 |
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H331 .882 .732 .0248 .046 |
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H332 .020 .719 .060 .024 |
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H341 .970 .8296 .069 .07 |
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H342 .926 .904 .107 .037 |
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H351 .795 .225 .3796 .036 |
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H352 .715 .173 .430 .11 |
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