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CaCoSi2O6 |
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Mantovani L, Tribaudino M, Mezzadri F, Calestani G, Bromiley G |
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American Mineralogist 98 (2013) 1241-1252 |
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The structure of (Ca,Co)CoSi2O6 pyroxenes and the Ca-M2+ |
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substitution in (Ca,M2+)M2+Si2O6 pyroxenes (M2+=Co,Fe,Mg) |
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Sample: Ca0.8Co0.2 |
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Locality: synthetic |
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_database_code_amcsd 0019911 |
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9.794 8.953 5.243 90 105.66 90 C2/c |
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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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CaM2 0 .3012 .25 .80 .0072 .0096 .0048 .0052 0 -.0013 0 |
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CoM2 0 .2722 .25 .20 .0241 |
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CoM1 0 .90729 .25 .00614 .0067 .0056 .0057 0 .00113 0 |
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Si .28801 .09234 .23231 .00515 .0054 .0046 .0054 -.00044 .0013 -.00049 |
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O1 .11780 .08846 .1473 .0071 .0055 .0076 .0080 .0005 .0015 .0003 |
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O2 .36175 .24860 .3239 .0103 .0125 .0073 .0115 -.0029 .0043 -.0015 |
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O3 .35101 .01981 .9949 .0080 .0072 .0103 .0068 .0002 .0026 -.0021 |
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View JMOL 3-D Structure (permalink) |
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