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Vesuvianite |
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Galuskin E V, Armbruster T, Malsy A, Galuskina I O, Sitarz M |
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The Canadian Mineralogist 41 (2003) 843-856 |
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Morphology, composition and structure of low-temperature P4/nnc high-fluorine |
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vesuvianite whiskers from Polar Yakutia, Russia |
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Sample: VES1 |
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Locality: Dokichan River, Tas-Khayakhtakh Mountains, Russia |
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_database_code_amcsd 0005861 |
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15.536 15.536 11.781 90 90 90 *P4/nnc |
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.25 .25 .25 |
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atom x y z occ Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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CaX1 3/4 1/4 3/4 .73 .0127 .0094 .0055 0 0 0 |
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CaX2 .68911 .04353 .87969 .643 .0073 .0102 .0069 -.0011 .0008 .0003 |
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CaX3 .40087 .17881 .61380 1.002 .0117 .0111 .0153 -.0033 .0046 -.0028 |
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CaX4 3/4 -1/4 .8612 .46 1.02 .0094 .0094 .020 0 0 0 |
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NaX4 3/4 -1/4 .8612 .04 1.02 .0094 .0094 .020 0 0 0 |
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FeY1 3/4 -1/4 .9410 .5 1.88 .0089 .0089 .054 0 0 0 |
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AlY2 1/2 0 1/2 .55 .0066 .0060 .0082 -.0007 -.0006 .0008 |
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AlY3 .61247 .37918 .87343 .750 .54 .0075 .0071 .0059 -.0003 .0007 .0000 |
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FeY3 .61247 .37918 .87343 .041 .54 .0075 .0071 .0059 -.0003 .0007 .0000 |
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MgY3 .61247 .37918 .87343 .155 .54 .0075 .0071 .0059 -.0003 .0007 .0000 |
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TiY3 .61247 .37918 .87343 .054 .54 .0075 .0071 .0059 -.0003 .0007 .0000 |
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SiZ1 3/4 1/4 0 .955 .36 .0054 .0054 .0029 0 0 0 |
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SiZ2 .54086 .18095 .87130 .50 .0072 .0063 .0056 .0000 .0005 .0002 |
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SiZ3 .65062 -.08243 .63537 .59 .0059 .0104 .0059 -.0005 -.0001 -.0005 |
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O1 .7196 .3275 .9143 .67 .0113 .0073 .0070 -.0001 .0002 -.0002 |
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O2 .6171 .1597 .7791 .72 .0090 .0091 .0092 -.0002 .0018 .0010 |
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O3 .5495 .2785 .9240 .61 .0086 .0077 .0069 .0001 -.0001 .0003 |
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O4 .5623 .1066 .9703 .65 .0096 .0071 .0080 -.0002 .0016 .0008 |
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O5 .6700 .0157 .6787 .79 .0087 .0126 .0088 -.0030 -.0008 -.0009 |
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O6 .7289 -.1167 .5593 1.15 .0114 .023 .0099 .0034 .0025 .0021 |
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O7 .4440 .1743 .8225 .84 .0088 .0120 .0111 -.0010 -.0012 .0010 |
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O8 .5906 -.0609 .9337 .71 .0093 .0086 .0091 -.0002 .0017 -.0019 |
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O9 .6436 -.1436 3/4 .90 .0136 .0136 .007 .002 .0005 .0005 |
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O10A 3/4 -1/4 .111 .5 2.7 .025 .025 .054 0 0 0 |
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Cl10B 3/4 -1/4 .1633 .216 2.9 .010 .010 .091 0 0 0 |
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F10B 3/4 -1/4 .1633 .284 2.9 .010 .010 .091 0 0 0 |
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F11 .4374 -.0051 .8643 .289 .81 .0120 .0100 .0089 .0000 .0005 .0016 |
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O11 .4374 -.0051 .8643 .711 .81 .0120 .0100 .0089 .0000 .0005 .0016 |
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H11 .457 .013 .809 .711 3.95 |
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AlT1 .440 .060 3/4 .016 .79 |
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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 (permalink) |
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