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Ba6 Co25 S27 |
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Snyder G, Badding M, DiSalvo F |
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Inorganic Chemistry 31 (1992) 2107-2110 |
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Synthesis, structure and properties of Ba6Co25S27: a perovskite- |
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like superstructure of Co8S6 and Ba6S clusters |
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_cod_database_code 1005012 |
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_database_code_amcsd 0012703 |
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10.033 10.033 10.033 90 90 90 Pm3m |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ba1 .5 .5 .19603 .017 .017 .012 0 0 0 |
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Co1 .13220 .36218 .13220 .014 .018 .014 -.001 .000 -.001 |
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Co2 0 0 0 .012 .012 .012 0 0 0 |
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S1 .5 .5 .5 .015 .015 .015 0 0 0 |
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S2 0 .2361 0 .014 .012 .014 0 0 .16 |
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S3 .2767 .2767 .2767 .016 .016 .016 .003 .003 .003 |
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S4 0 .5 .2462 .015 .015 .012 0 0 0 |
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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
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Ba Co S2 |
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Snyder G, Gelabert M, DiSalvo F |
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Journal of Solid State Chemistry 113 (1994) 355-361 |
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Refined structure and properties of the layered Mott insulator Ba Co S2 |
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_cod_database_code 1005016 |
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_database_code_amcsd 0013832 |
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6.4413 6.4926 8.9406 90 90 90 Cmma |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ba1 0 .25 .1981 .019 .011 .013 0 0 0 |
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Co1 0 .25 .5932 .023 .016 .014 0 0 0 |
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S1 0 .25 .8496 .021 .009 .011 0 0 0 |
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S2 .25 .5 .5 .013 .062 .017 0 0 0 |
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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
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