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Giniite |
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Corbin D R, Whitney J F, Fultz W C, Stucky G D, Eddy M M, Cheetham A K |
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Inorganic Chemistry 25 (1986) 2279-2280 |
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Synthesis of open-framework transition-metal phosphates using organometallic |
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precursors in acidic media. Preparation and structural characterization of |
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Fe5P4O20H10 and NaFe3P3O12 |
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Note: structure from ICSD |
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17.4920 9.038 9.349 90 96.23 90 C2/c |
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atom x y z Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Fe1 .5 .5984 .25 .0055 .0064 .0053 0 .0008 0 |
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Fe2 .31640 .08846 .18716 .0053 .0074 .0079 .0003 .0010 .0004 |
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Fe3 .32579 .47315 .12958 .0054 .0061 .0067 .0003 .0002 -.0010 |
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P1 .4175 .3198 .4100 .0049 .0052 .0045 .0008 -.0005 -.0003 |
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P2 .3392 .7582 .3688 .0042 .0059 .0054 .0001 .0005 -.0005 |
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O1 .4248 .7633 .3380 .006 .011 .009 .001 .000 .001 |
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O9 .2408 .5750 -.0322 .007 .010 .008 .002 .001 -.001 |
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O2 .4224 .4321 .2897 .004 .009 .010 .001 -.001 .002 |
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O3 .4898 .2157 .4199 .007 .013 .010 .008 -.002 -.005 |
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O4 .4165 .3933 .5575 .007 .009 .008 .002 -.001 -.004 |
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O5 .3458 .2244 .3689 .010 .010 .007 -.001 .000 -.002 |
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O6 .3355 .7296 .5320 .007 .010 .006 .000 .002 .003 |
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O7 .4201 -.0055 .1517 .010 .013 .018 .001 .005 .003 |
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O8 .2974 .6319 .2809 .004 .007 .010 -.002 .000 -.001 |
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O10 .2984 .9045 .3261 .010 .009 .006 .005 .001 .001 |
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H1 .4608 .050 .136 5.5 |
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H2 .4426 -.084 .226 6.9 |
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H3 .234 .684 .004 16.7 |
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