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Faheyite |
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Cooper M A, Hawthorne F C |
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The Canadian Mineralogist 53 (2015) 199-208 |
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The crystal structure of faheyite, Mn2+Fe3+2[Be2(PO4)4](H2O)6: |
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a new twist for the [Be(PPhi4)2] chain |
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Locality: Roosevelt mine, South Dakota, USA |
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_database_code_amcsd 0020881 |
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9.404 9.404 15.920 90 90 120 P3_121 |
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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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Be .844 .6861 .084 .016 .016 .016 .016 .0080 -.0001 .0001 |
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Mn2+ 0 -.0012 1/6 .0218 .0235 .0246 .0169 .0117 -.0013 -.0007 |
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Fe3+ .5536 .10775 .0826 .0152 .0176 .0205 .0038 .0067 .0007 .0003 |
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P1 .6093 .7910 .0909 .0155 .017 .018 .010 .0069 .0006 .0002 |
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P2 .1799 .7922 .0815 .0103 .0117 .0123 .0044 .0041 .0001 -.0013 |
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O1 .7815 .8167 .1013 .014 .014 .014 .013 .0069 .0003 .0001 |
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O2 .493 .638 .1357 .021 .021 .021 .020 .0102 .0003 .0003 |
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O3 .608 .9465 .1226 .020 .021 .021 .019 .010 -.0005 .0002 |
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O4 .5704 .7657 -.0016 .017 .018 .018 .016 .0082 .0001 -.0002 |
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O5 .1993 .7619 .1726 .011 .011 .011 .009 .0053 .0003 -.0002 |
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O6 .143 .636 .0305 .015 .015 .015 .013 .0068 .0002 -.0005 |
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O7 .3337 .9412 .0444 .010 .010 .011 .009 .0045 -.0002 .0003 |
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O8 .041 .834 .0710 .016 .016 .016 .015 .0074 .0002 -.0004 |
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Wat9 .799 .292 .1167 .023 .023 .023 .022 .011 -.0004 -.0001 |
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Wat10 .492 .2894 .0500 .018 .019 .018 .017 .009 -.0002 .0003 |
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Wat11 .097 .2144 .0893 .040 .040 .040 .040 .0197 .0000 .0004 |
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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