American Mineralogist Crystal Structure Database

1 matching records for this search.

Geschieberite
 
Alekseev E V, Suleimanov E V, Chuprunov E V, Marychev M O, Ivanov V A, Fukin G K
 
Crystallography Reports 51 (2006) 29-33
Crystal structure and nonlinear optical properties of the K2UO2(SO4)2*2H2O
compound at 293 K
Locality: Synthetic
_database_code_amcsd 0020465
13.773 7.288 11.556 90 90 90 Pna2_1
atom        x       y       z   Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3) U(2,3)
K1     .93060 -.23782  .54651  .0263  .0092  .0245  .0453   .0016 -.0034  .0033
K2     .92862 -.23892  .97288  .0210  .0162  .0100  .0369  -.0007  .0011 -.0058
U1    .744807 .085624  .76040 .00437 .00702 .00439 .00171 -.00029 .00187 .00210
S1     .82327  .25669  .47873  .0060  .0085  .0045  .0050   .0005  .0001  .0010
S2     .82366  .25576 1.03854  .0067  .0088  .0058  .0054  -.0010 -.0002 -.0013
O1      .8722   .0677   .7603  .0155  .0146  .0162  .0157  -.0002  .0000 -.0001
O2      .6172   .1029   .7633  .0130  .0127  .0136  .0127  -.0008  .0000  .0000
O3      .7521   .1947   .9507  .0104  .0115  .0103  .0095  -.0007 -.0009 -.0002
O4      .7529   .2208   .5769  .0050  .0064  .0042  .0044  -.0002  .0015  .0004
O5      .7682   .3273   .3825  .0171  .0177  .0171  .0165   .0004  .0002  .0012
O6      .7571   .3288  1.1354  .0023  .0031  .0026  .0011   .0002 -.0005 -.0015
Wat7    .7356   .4311   .7637  .0152  .0172  .0137  .0147   .0007 -.0003  .0004
O8      .8943   .3938   .5104  .0114  .0114  .0108  .0118  -.0019 -.0008 -.0002
O9      .8662   .0821   .4388  .0119  .0121  .0110  .0127   .0015  .0001 -.0018
O10     .8901   .3909   .9910  .0173  .0175  .0166  .0177  -.0015  .0010  .0003
O11     .8785   .0946  1.0758  .0130  .0130  .0121  .0140   .0008  .0000  .0013
Wat12   .9306  -.3996   .7579  .0296  .0272  .0348  .0267   .0042   .001   .004
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