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Ba F9 Fe2 Na |
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Ferey G, Leblanc M, Kozak A, Samouel M, Pannetier J |
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Journal of Solid State Chemistry 56 (1985) 288-297 |
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Crystal structures of Na Ba Cr2 F9 and Na Ba Fe2 F9 Structural |
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correlations with other enneafluorides, particularly with KPbCr2F9 |
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_cod_database_code 1000205 |
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_database_code_amcsd 0013535 |
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7.363 17.527 5.484 90 91.50 90 P2_1/n |
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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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Na1 .3102 .0408 .7490 .0116 .0161 .0165 -.0028 -.0089 -.0061 |
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Ba1 .0679 .2851 .7260 .0093 .0048 .0135 -.0008 -.0019 -.0008 |
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Fe1 .4080 .6238 .2238 .0071 .0022 .0077 -.0002 -.0035 .0008 |
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Fe2 .2702 .4185 .2629 .0069 .0030 .0093 .0000 -.0013 .0000 |
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F1 .1339 .4181 -.0303 .0235 .0177 .0128 -.0024 -.0122 -.0055 |
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F2 .0022 .9223 .4173 .0124 .0054 .0153 .0007 .0037 .0013 |
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F3 .2843 .3115 .2928 .0223 .0058 .0282 -.0023 .0072 .0017 |
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F4 .4390 .9176 .0470 .0143 .0166 .0157 -.0003 .0051 -.0028 |
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F5 .2754 .1643 .4867 .0136 .0123 .0150 -.0029 -.0032 .0003 |
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F6 .2040 .1640 .0023 .0231 .0091 .0091 .0010 .0029 .0058 |
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F7 .2376 .0307 .2449 .0083 .0025 .0210 .0006 .0013 -.0018 |
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F8 .4352 .2912 .8169 .0168 .0110 .0190 -.0026 -.0055 .0038 |
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F9 .4063 .4303 .5796 .0141 .0106 .0100 -.0018 -.0055 .0014 |
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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