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Tiragalloite |
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Gramaccioli C M, Pilati T, Liborio G |
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Acta Crystallographica B35 (1979) 2287-2291 |
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Structure of a manganese(II) arsenatotrisilicate, Mn4[AsSi3O12(OH)]: |
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The presence of a new tetrapolyphosphate-like anion |
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Locality: Molinello, near Chiavari, Liguria, |
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Note: Displacement parameters taken from ICSD |
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_database_code_amcsd 0009690 |
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6.66 19.92 7.67 90 95.7 90 P2_1/n |
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atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Mn1 .25844 .64836 -.14601 .00172 .00020 .00443 .00014 -.00023 .00003 |
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Mn2 -.45780 .58376 .54669 .00139 .00023 .00431 -.00003 .00036 -.00005 |
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Mn3 .76253 .50915 .24515 .00239 .00037 .00457 -.00040 .00010 -.00037 |
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Mn4 .05246 .74596 .13942 .00204 .00026 .00506 .00008 .00006 -.00015 |
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As .43066 .30163 -.21252 .00334 .00044 .00538 -.00005 .00017 .00006 |
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Si1 .23118 .36790 .08072 .00292 .00028 .00554 .00008 .00041 -.00022 |
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Si2 .26741 .52059 .16158 .00276 .00029 .00524 .00001 -.00014 .00001 |
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Si3 .04814 .59788 .44013 .00283 .00039 .00521 .00005 -.00009 .00005 |
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O1 .27074 .23802 -.18296 .0044 .00046 .00671 -.00021 .00078 -.00006 |
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O2 .45977 .31980 -.42138 .0092 .00047 .00579 .00022 .00162 .00013 |
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O3 .64941 .28926 -.09053 .0030 .00098 .00687 .00052 -.00087 -.00026 |
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O4 .31652 .36999 -.12036 .0035 .00045 .00538 -.00029 .00063 -.00004 |
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O5 .03333 .32369 .07199 .0060 .00033 .00577 -.00053 .00029 -.00037 |
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O6 .41456 .34321 .21941 .0040 .00039 .00533 -.00023 .00070 .00034 |
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O7 .17699 .44584 .11549 .0023 .00019 .0092 -.00003 -.00013 -.00045 |
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O8 .30120 .55324 -.02563 .0049 .00052 .00438 .00022 -.00045 .00025 |
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O9 .45704 .51577 .30760 .0036 .00029 .00533 .00014 -.00028 .00025 |
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O10 .08685 .55831 .25473 .0030 .00063 .00481 .00061 -.00041 .00021 |
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O11 .04933 .67785 .38415 .0068 .00026 .00821 -.00056 -.00105 .00008 |
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O12 .22133 .58601 .60057 .0026 .00048 .00583 -.00029 -.00032 .00007 |
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O13 -.16437 .56880 .47657 .0049 .00059 .00598 -.00037 .00055 -.00022 |
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H .14 .71 .45 3 |
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Medaite |
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Gramaccioli C M, Liborio G, Pilati T |
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Acta Crystallographica B37 (1981) 1972-1978 |
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Structure of medaite, Mn6[VSi5O18(OH)]: The presence of a new kind of |
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heteropolysilicate anion |
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Locality: Molinello, Chavari, Liguria, Italy |
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Note: anisoB's from ICSD |
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_database_code_amcsd 0009748 |
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6.712 28.948 7.578 90 95.40 90 P2_1/n |
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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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Mn1 .3700 .02239 .1546 .962 .67 .0013 .00041 .0049 .00002 .0011 -.00005 |
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Ca1 .3700 .02239 .1546 .032 .67 .0013 .00041 .0049 .00002 .0011 -.00005 |
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Fe1 .3700 .02239 .1546 .058 .67 .0013 .00041 .0049 .00002 .0011 -.00005 |
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Mn2 .6808 .31736 .0237 .962 .69 .0023 .00039 .0048 -.00003 .0012 -.00005 |
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Ca2 .6808 .31736 .0237 .032 .69 .0023 .00039 .0048 -.00003 .0012 -.00005 |
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Fe2 .6808 .31736 .0237 .058 .69 .0023 .00039 .0048 -.00003 .0012 -.00005 |
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Mn3 .4556 .13625 .2214 .962 .67 .0013 .00042 .0049 -.00006 .0012 -.00004 |
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Ca3 .4556 .13625 .2214 .032 .67 .0013 .00042 .0049 -.00006 .0012 -.00004 |
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Fe3 .4556 .13625 .2214 .058 .67 .0013 .00042 .0049 -.00006 .0012 -.00004 |
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Mn4 .6687 .08683 .9182 .962 .75 .0019 .00044 .0053 -.00011 .0011 -.00013 |
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Ca4 .6687 .08683 .9182 .032 .75 .0019 .00044 .0053 -.00011 .0011 -.00013 |
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Fe4 .6687 .08683 .9182 .058 .75 .0019 .00044 .0053 -.00011 .0011 -.00013 |
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Mn5 .1412 .07642 .4413 .962 .94 .0035 .00053 .0062 -.00004 .0011 -.00015 |
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Ca5 .1412 .07642 .4413 .032 .94 .0035 .00053 .0062 -.00004 .0011 -.00015 |
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Fe5 .1412 .07642 .4413 .058 .94 .0035 .00053 .0062 -.00004 .0011 -.00015 |
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Mn6 .4742 .25294 .3087 .962 .83 .0027 .00046 .0060 -.00001 .0014 .00010 |
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Ca6 .4742 .25294 .3087 .032 .83 .0027 .00046 .0060 -.00001 .0014 .00010 |
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Fe6 .4742 .25294 .3087 .058 .83 .0027 .00046 .0060 -.00001 .0014 .00010 |
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V .4926 .21363 .8804 .815 .88 .0030 .00049 .0061 -.00002 .0014 -.00001 |
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As .4926 .21363 .8804 .185 .88 .0030 .00049 .0061 -.00002 .0014 -.00001 |
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Si1 .6940 .16672 .5892 .88 .0025 .00049 .0066 -.00011 .0014 .00005 |
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Si2 .6415 .06220 .5159 .80 .0023 .00046 .0057 .00011 .0012 -.00001 |
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Si3 .8652 .01208 .2289 .86 .0024 .00049 .0061 .00002 .0011 -.00001 |
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Si4 .8158 -.09403 .1653 .83 .0023 .00049 .0057 -.00007 .0014 .00002 |
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Si5 .0371 -.14571 -.1141 .84 .0018 .00050 .0062 .00001 .0013 .00004 |
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O1 .6544 .25772 .8557 1.05 .0053 .00050 .0073 -.00008 .0021 -.00019 |
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O2 .4569 .20238 .0889 1.09 .0068 .00048 .0071 -.00025 .0022 .00011 |
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O3 .2796 .22463 .7593 1.17 .0045 .00067 .0074 .00026 .0016 -.00030 |
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O4 .6062 .16425 .7890 1.06 .0048 .00062 .0062 -.00025 .0022 -.00014 |
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O5 .5124 .18469 .4500 1.08 .0054 .00065 .0055 .00024 .0025 0 |
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O6 .8896 .19857 .6003 .91 .0025 .00047 .0073 -.00033 .0010 .00000 |
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O7 .7529 .11262 .5523 1.07 .0037 .00054 .0079 -.00004 .0003 -.00006 |
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O8 .4475 .06913 .3759 1.03 .0041 .00061 .0061 -.00028 .0018 -.00017 |
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O9 .5989 .04201 .7042 .95 .0028 .00056 .0063 .00018 .0012 .00006 |
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O10 .8053 .03026 .4235 1.05 .0042 .00060 .0062 .00038 .0000 -.00012 |
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O11 .0747 .03697 .2093 1.00 .0025 .00049 .0088 -.00033 .0019 -.00021 |
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O12 .6854 .02299 .0754 .87 .0033 .00049 .0057 .00008 .0013 .00018 |
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O13 .8978 -.04393 .2448 .95 .0025 .00043 .0084 -.00030 .0005 -.00028 |
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O14 .6306 -.09027 .0132 .86 .0020 .00055 .0057 .0006 .0015 .00006 |
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O15 .7787 -.12081 .3443 1.04 .0064 .00049 .0062 -.00006 .0010 .00011 |
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O16 .0031 -.11675 .0684 .91 .0028 .00053 .0062 .00013 .0015 -.00011 |
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O17 .2526 -.12771 -.1532 1.01 .0028 .00063 .0067 -.00016 .0020 -.00024 |
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O18 .8647 -.13917 -.2766 .90 .0039 .00052 .0052 -.00008 .0009 -.00001 |
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O19 .0326 -.20096 -.0516 1.30 .0108 .00055 .0064 -.00008 .0012 -.00011 |
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H .967 -.215 -.159 1.3 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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