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Ericssonite |
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Matsubara S |
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Mineralogical Journal 10 (1980) 107-121 |
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The crystal structure of orthoericssonite |
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Note: this is the orthorhombic polytype |
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Locality: Hijikuzu mine, Iwate Prefecture, Japan |
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_database_code_amcsd 0014422 |
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20.230 6.979 5.392 90 90 90 Pnmn |
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atom x y z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) |
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Ba .22483 0 .1644 .7 .76 .00053 .00357 .00618 0 0 0 |
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Sr .22483 0 .1644 .3 .76 .00053 .00357 .00618 0 0 0 |
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Mn1 0 .2596 0 .7 .73 .00064 .00331 .00431 0 .00045 0 |
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Fe12+ 0 .2596 0 .3 .85 .00064 .00331 .00431 0 .00045 0 |
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Mn2 0 0 .5 .7 .73 .00056 .00431 .00674 0 .00011 0 |
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Fe22+ 0 0 .5 .3 .53 .00056 .00431 .00674 0 .00011 0 |
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Mn3 0 .5 .5 .7 .85 .00037 .00338 .00272 0 .00032 0 |
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Fe32+ 0 .5 .5 .3 .53 .00037 .00338 .00272 0 .00032 0 |
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Fe3+ .14291 .5 .1663 .9 .41 .00024 .00297 .00233 0 .00008 0 |
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Ti .14291 .5 .1663 .1 .41 .00024 .00297 .00233 0 .00008 0 |
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Si .13640 .2262 .6644 .42 .00028 .00194 .00371 .00007 .00008 -.00024 |
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O1 .0507 0 .1657 1.22 .00071 .0071 .00952 0 -.00002 0 |
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O2 .1582 0 .6624 1.36 .00065 .00159 .0232 0 .00005 0 |
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O3 .0567 .2465 .6617 .81 .00034 .00527 .00726 .00028 .00034 .0005 |
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O4 .1708 .3087 .9137 1.04 .00049 .00854 .00559 .00019 -.00014 -.00167 |
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O5 .1722 .3086 .418 .98 .00051 .00716 .00608 .00001 .00034 .0021 |
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O6 .0523 .5 .1730 .59 .00027 .00365 .00524 0 .00011 0 |
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View JMOL 3-D Structure (permalink)
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