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FeFe2(PO3OH)4(H2O)4 |
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Vencato I, Mascarenhas Y P, Mattievich E |
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American Mineralogist 71 (1986) 222-226 |
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The crystal structure of FeFe2(PO3OH)4(H2O)4: a new synthetic |
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compound of mineralogic interest |
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_database_code_amcsd 0001010 |
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5.152 16.629 8.749 90 90.8 90 P2_1/n |
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atom x y z Biso |
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Fe1 .5 .5 .5 1.01 |
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Fe2 .2539 .2029 .3683 .75 |
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P1 .7454 .3060 .4938 .59 |
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P2 .7645 .0794 .3054 .81 |
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O1 .4768 .2988 .4210 1.0 |
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O2 .764 .2648 .6493 1.3 |
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O3 .7872 .4008 .5156 .9 |
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O4 .9579 .2772 .3872 1.0 |
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O5 .0410 .1061 .3417 1.3 |
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O6 .563 .1381 .3559 1.6 |
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O7 .7337 .0573 .1362 1.3 |
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O8 .709 -.0006 .3986 2.6 |
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OW1 .310 .4432 .3059 1.9 |
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OW2 .237 .1769 .6010 1.6 |
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H1W1 .3641 .3933 .3536 1.9 |
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H2W1 .1271 .4381 .2923 1.9 |
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H1W2 .0612 .2001 .6442 1.6 |
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H2W2 .3762 .1948 .6852 1.6 |
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H1 .8738 .4089 .6177 .9 |
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H2 .6415 .0019 .4965 2.6 |
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Lipscombite |
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Vencato I, Mattievich E, Mascarenhas Y P |
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American Mineralogist 74 (1989) 456-460 |
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Crystal structure of synthetic lipscombite: A redetermination |
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_database_code_amcsd 0001230 |
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7.310 7.310 13.212 90 90 90 P4_32_12 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Fe1 .368 .368 0 .782 0.046 0.046 0.016 -0.026 -0.002 0.002 |
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Fe2 .138 .138 .5 .164 0.031 0.031 0.038 -0.017 -0.027 0.027 |
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Fe3 .1489 .3821 .2458 .0006 0.008 0.030 0 0 0 |
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P .257 .000 .124 0.021 0.007 0.017 0.003 0.005 0.010 |
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O1 .386 .0112 .053 0.028 0.021 0.034 0.007 0.010 -0.012 |
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O2 .134 .129 .184 0.029 0.014 0.037 -0.005 0.009 -0.002 |
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O3 .138 -.132 .062 0.046 0.036 0.048 0.000 -0.006 0.001 |
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O4 .372 -.113 .193 0.028 0.029 0.032 -0.004 -0.015 0.002 |
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OH .012 .235 .373 0.015 0.015 0.010 -0.002 0.004 0.005 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure
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