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Ba Ni O7 P2 |
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Riou D, Leligny H, Pham C, Labbe P, Raveau B |
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Acta Crystallographica B47 (1991) 608-617 |
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BaNiP2O7, a triclinic diphosphate with a modulated structure ofthe |
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displacive type |
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_cod_database_code 1001511 |
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_database_code_amcsd 0010491 |
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5.317 7.580 7.116 101.26 84.48 89.49 P-1 |
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atom x y z occ |
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Ba1 .1841 .0667 .21715 .5 |
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Ba2 .2294 .07410 .23475 .5 |
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Ni1 .1798 .5911 .4069 .5 |
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Ni2 .1922 .6153 .3316 .5 |
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P1 .7036 .3940 .2194 .5 |
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P2 .7072 .4218 .1611 .5 |
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P3 .6974 .7896 .2736 |
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O1 .9250 .8013 .3934 |
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O2 .446 .7959 .3970 |
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O3 .710 .9337 .1521 |
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O4 .729 .6008 .1276 |
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O5 .908 .410 .303 .5 |
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O6 .886 .411 .381 .5 |
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O7 .772 .298 -.033 .5 |
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O8 .794 .242 .055 .5 |
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O9 .5630 .6017 .722 |
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