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Frondelite |
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Redhammer G J, Roth G, Tippelt G, Bernroider M, |
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Lottermoser W, Amthauer G, Hochleitner R |
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Acta Crystallographica C62 (2006) i24-i28 |
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Manganoan rockbridgeite Fe4.32Mn0.62Zn0.06(PO4)3(OH)5: |
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structure analysis and 57Fe Mossbauer spectroscopy |
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Locality: Hagendorf pegmatite, Bavaria, Germany |
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_database_code_amcsd 0017679 |
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5.1761 13.9774 16.8689 90 90 90 Cmcm |
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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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Fe1 0 0 0 .0113 .0125 .0104 .0110 .000 .000 -.0003 |
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Fe2 0 .06813 .15645 .66 .0165 .0240 .0134 .0122 .000 .000 -.0003 |
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Mn2 0 .06813 .15645 .31 .0165 .0240 .0134 .0122 .000 .000 -.0003 |
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Zn2 0 .06813 .15645 .03 .0165 .0240 .0134 .0122 .000 .000 -.0003 |
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Fe3 .2305 .32125 .13886 .50 .0093 .0109 .0092 .0077 .0020 -.0002 -.0009 |
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P1 .5 .14322 .04337 .0098 .0143 .0083 .0068 .000 .000 -.0008 |
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P2 0 .48232 .25 .0120 .0160 .0104 .0095 .000 .000 .000 |
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O1 .2438 .5456 .25 .0209 .026 .020 .017 -.009 .000 .000 |
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O2 .2572 .0811 .05719 .0143 .0134 .0141 .0154 -.0046 -.0011 -.0032 |
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Oh3 .3793 .3127 .2500 .50 .0140 .014 .018 .009 .004 .000 .000 |
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O4 .5 .1822 -.0401 .0229 .043 .016 .009 .000 .000 .0026 |
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OH5 0 .2175 .1760 .0215 .041 .013 .010 .000 .000 .0015 |
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Oh6 .5 .4233 .1045 .0136 .016 .009 .016 .000 .000 .0014 |
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O7 0 .4204 .1748 .0159 .022 .017 .0089 .000 .000 -.0020 |
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O8 .5 .2220 .1068 .0115 .014 .010 .011 .000 .000 -.0017 |
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H3 .5 .243 .2500 .05 |
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H6 .5 .4045 .0650 .07 |
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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