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Kambaldaite |
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Engelhardt L M, Hall S R, White A H |
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American Mineralogist 70 (1985) 423-427 |
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Crystal Structure of kambaldaite, Na2Ni8(CO3)6(OH)6(H2O)6 |
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Note: U(1,2) for Na and for Ni2 has been altered to match symmetry constraints |
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_database_code_amcsd 0000983 |
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10.340 10.340 6.097 90 90 120 P6_3 |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Na 0 0 .3745 .0211 .0211 .0133 .01055 0 0 |
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Ni1 .5126 -.0019 .25 .0072 .0053 .0067 .0020 .0005 .0001 |
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Ni2 2/3 1/3 .6374 .0059 .0059 .0079 .00295 0 0 |
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C .7796 .2172 .008 .003 .007 .008 .0020 .0000 .0010 |
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O1 .7324 .1386 .1801 .005 .009 .010 .0000 .0000 .0020 |
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O2 .7015 .1836 -.1705 .008 .010 .007 .0040 -.0020 .0000 |
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O3 .9129 .3343 .007 .005 .009 .009 .0020 .0000 .0010 |
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O4 .5188 .1377 .4873 .010 .006 .006 .0060 -.0010 -.0010 |
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H1 .467 .159 .433 .015 |
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O5 .0998 .1948 .1233 .020 .016 .037 .0080 .0000 .0000 |
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H2 .081 .237 .107 .022 |
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H3 .17 .234 .179 .022 |
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