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Kobyashevite |
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Strandberg H, Langer V, Johansson L G |
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Acta Chemica Scandinavica 49 (1995) 5-10 |
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Structure of Cu2.5(OH)3SO4*2H2O: a novel corrosion product of copper |
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Locality: synthetic |
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_database_code_amcsd 0018667 |
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6.064 11.012 5.490 102.68 92.43 92.06 P-1 |
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atom x y z Biso |
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Cu1 0 0 0 .8 |
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Cu2 .5 0 0 .8 |
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Cu3 .7510 -.0028 .5044 .79 |
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Cu4 .5 .5 0 1.2 |
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S .8234 .2777 .2869 .8 |
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O1 .768 .145 .245 .9 |
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O2 .965 .296 .087 1.2 |
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O3 .621 .345 .278 1.1 |
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O4 .938 .321 .531 1.4 |
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OH1 .736 -.093 .834 1.4 |
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OH2 .501 .084 .707 .5 |
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OH3 .006 .081 .711 1.1 |
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Wat1 .225 .492 .148 1.5 |
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Wat2 .388 .361 -.296 1.6 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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Kobyashevite |
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Pekov I V, Zubkova N V, Yapaskurt V O, Belakovskiy D I, Chukanov N V, Kasatkin A V, |
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Kuznetsov A M, Pushcharovsky D Y |
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Mineralogy and Petrology 107 (2013) 201-210 |
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Kobyashevite, Cu5(SO4)2(OH)6*4H2O, a new devilline-group mineral from the Vishnevye |
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Mountains, South Urals, Russia |
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Locality: Kapitalnaya mine, South Urals, Russia |
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_database_code_amcsd 0020496 |
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6.0731 11.0597 5.5094 102.883 92.348 92.597 P-1 |
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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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Cu1 0 0 0 .0147 .0104 .0232 .0105 -.0008 .0013 .0039 |
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Cu2 .5 0 0 .0153 .0103 .0235 .0125 .0013 .0033 .0044 |
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Cu3 .75095 -.00256 .50483 .01379 .0083 .0217 .0111 .0000 .0018 .0031 |
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Cu4 .5 .5 0 .0306 .0229 .0261 .0355 -.0078 .0141 -.0090 |
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S1 .82222 .27673 .2863 .0178 .0181 .0150 .0197 .0012 .0051 .0019 |
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O1 .7350 -.0911 .8362 .0148 .0137 .016 .0152 -.0001 .0005 .0051 |
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H1 .713 -.1710 .838 .014 |
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O2 .5030 .0829 .7097 .0150 .0143 .018 .0133 -.0004 -.0001 .0040 |
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H2 .512 .1660 .744 .014 |
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O3 .0089 .0791 .7108 .0133 .0102 .015 .0134 .0006 .0017 .0004 |
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H3 -.009 .1599 .758 .014 |
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O4 .7673 .1421 .2472 .0168 .0152 .015 .0210 .0008 .0028 .0049 |
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O5 .9675 .2970 .0928 .0277 .0334 .023 .0260 -.0046 .0188 .0030 |
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O6 .6184 .3422 .2754 .0313 .0285 .029 .039 .0134 .0093 .0101 |
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O7 .9387 .3213 .5325 .0274 .0253 .030 .0217 .0039 .0011 -.0064 |
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O8 .2281 .4931 .1509 .0350 .027 .020 .051 -.0081 .0217 -.007 |
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H81 .139 .424 .122 .026 |
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H82 .165 .555 .252 .09 |
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O9 .3910 .3624 .7086 .0248 .0149 .029 .028 -.0029 .0075 .0010 |
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H91 .249 .365 .663 .052 |
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H92 .488 .390 .613 .09 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
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