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Geschieberite |
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Niinisto L, Toivonen J, Valkonen J |
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Acta Chemica Scandinavica A33 (1979) 621-624 |
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Uranyl(VI) compounds. II. The crystal structure of |
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potassium uranyl sulfate dihydrate, K2UO2(SO4)2*2H2O |
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Locality: synthetic |
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_database_code_amcsd 0020637 |
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13.806 11.577 7.292 90 90 90 Pnma |
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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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K .4298 .4624 .2380 .0148 .0443 .0211 .0025 -.0003 .0061 |
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U .7446 .25 .5857 .0106 .0038 .0067 0 -.0003 0 |
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S .6761 .4701 .2563 .0148 .0080 .0087 .0001 -.0006 .0007 |
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O1 .6173 .25 .6057 .014 |
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O2 .8702 .25 .5700 .014 |
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O3 .7512 .4357 .7095 .013 |
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O4 .7405 .3746 .3278 .012 |
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O5 .6053 .5109 .3926 .023 |
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O6 .6288 .4293 .0875 .020 |
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Wat7 .7369 .25 .9305 .018 |
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Wat8 .4334 .25 .3956 .042 |
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| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Geschieberite |
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Alekseev E V, Suleimanov E V, Chuprunov E V, Marychev M O, Ivanov V A, Fukin G K |
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Crystallography Reports 51 (2006) 29-33 |
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Crystal structure and nonlinear optical properties of the K2UO2(SO4)2*2H2O |
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compound at 293 K |
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Locality: Synthetic |
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_database_code_amcsd 0020465 |
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13.773 7.288 11.556 90 90 90 Pna2_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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K1 .93060 -.23782 .54651 .0263 .0092 .0245 .0453 .0016 -.0034 .0033 |
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K2 .92862 -.23892 .97288 .0210 .0162 .0100 .0369 -.0007 .0011 -.0058 |
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U1 .744807 .085624 .76040 .00437 .00702 .00439 .00171 -.00029 .00187 .00210 |
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S1 .82327 .25669 .47873 .0060 .0085 .0045 .0050 .0005 .0001 .0010 |
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S2 .82366 .25576 1.03854 .0067 .0088 .0058 .0054 -.0010 -.0002 -.0013 |
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O1 .8722 .0677 .7603 .0155 .0146 .0162 .0157 -.0002 .0000 -.0001 |
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O2 .6172 .1029 .7633 .0130 .0127 .0136 .0127 -.0008 .0000 .0000 |
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O3 .7521 .1947 .9507 .0104 .0115 .0103 .0095 -.0007 -.0009 -.0002 |
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O4 .7529 .2208 .5769 .0050 .0064 .0042 .0044 -.0002 .0015 .0004 |
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O5 .7682 .3273 .3825 .0171 .0177 .0171 .0165 .0004 .0002 .0012 |
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O6 .7571 .3288 1.1354 .0023 .0031 .0026 .0011 .0002 -.0005 -.0015 |
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Wat7 .7356 .4311 .7637 .0152 .0172 .0137 .0147 .0007 -.0003 .0004 |
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O8 .8943 .3938 .5104 .0114 .0114 .0108 .0118 -.0019 -.0008 -.0002 |
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O9 .8662 .0821 .4388 .0119 .0121 .0110 .0127 .0015 .0001 -.0018 |
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O10 .8901 .3909 .9910 .0173 .0175 .0166 .0177 -.0015 .0010 .0003 |
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O11 .8785 .0946 1.0758 .0130 .0130 .0121 .0140 .0008 .0000 .0013 |
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Wat12 .9306 -.3996 .7579 .0296 .0272 .0348 .0267 .0042 .001 .004 |
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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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Geschieberite |
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Plasil J, Hlousek J, Kasatkin A V, Skoda R, Novak M, Cejka J |
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Mineralogical Magazine 79 (2015) 205-216 |
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Geschieberite, K2(UO2)(SO4)2(H2O)2, a new uranyl sulfate mineral from Jachymov |
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Locality: Svornost mine, Jachymov, Czech Republic |
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_database_code_amcsd 0020741 |
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13.7778 7.2709 11.5488 90 90 90 Pna2_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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K1 .0698 .2399 .0351 .0324 .023 .020 .054 -.0006 .005 -.0049 |
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K2 -.0710 -.2371 -.0383 .0311 .024 .022 .047 .0010 -.001 -.0041 |
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U .255076 .91435 .250413 .01299 .01811 .00904 .01181 -.00029 -.0012 -.0034 |
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S1 .1762 .7435 -.0313 .0144 .018 .012 .013 .0014 .000 -.0036 |
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S2 -.1766 -.7442 .0283 .0157 .023 .008 .016 -.0016 .000 .0011 |
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Wat1 .2352 .0687 .7543 .0240 |
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O2 .2461 .797 .0624 .019 |
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O3 -.2483 -.785 -.0652 .020 |
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O4 .2584 .1703 .1244 .016 |
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O5 -.2657 -.1720 -.1282 .020 |
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Wat6 .0681 .3995 .2474 .0381 |
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O7 .1059 .6094 .0020 .027 |
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O8 -.1093 -.6058 -.0167 .021 |
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O9 .1330 .9146 -.0712 .020 |
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O10 -.1228 -.9086 .0655 .023 |
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O11 .3832 .8966 .2555 .0198 |
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O12 .1264 .9326 .2556 .0219 |
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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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