American Mineralogist Crystal Structure Database

2 matching records for this search.

Juabite
Download hom/juabite.pdf
Burns P C, Clark C M, Gault R A
Download cm/vol38/CM38_809.pdf
The Canadian Mineralogist 38 (2000) 809-816
Juabite, CaCu10(TeO3)4(AsO4)4(OH)2(H2O)4: Crystal structure and revision
of the chemical formula
_database_code_amcsd 0005685
8.9903 10.1197 8.9959 102.654 92.432 70.432 P-1
atom         x     y      z  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ca         1/2   1/2      0 .0248  .0468  .0188  .0059 -.0083 -.0050  .0018
Cu(1)   -.1919 .7993  .0021 .0117  .0085  .0258  .0029 -.0074 -.0032  .0055
Cu(2)    .2967 .8412 -.4883 .0104  .0071  .0222  .0045 -.0063 -.0044  .0065
Cu(3)    .3921 .5072 -.3755 .0142  .0124  .0202  .0093 -.0025 -.0036  .0072
Cu(4)    .6845 .8487 -.3708 .0129  .0066  .0323  .0031 -.0095 -.0031  .0066
Cu(5)   -.0734 .7991  .3909 .0154  .0095  .0340  .0060 -.0104 -.0051  .0073
Te(1)    .4568 .8379 -.1518 .0114  .0099  .0216  .0056 -.0081 -.0027  .0047
Te(2)    .1303 .8342  .1698 .0196  .0162  .0358  .0108 -.0121 -.0037  .0086
As(1)    .0656 .7706 -.2751 .0097  .0056  .0220  .0031 -.0060 -.0040  .0046
As(2)    .5743 .7899 -.7274 .0082  .0061  .0178  .0018 -.0046 -.0031  .0041
O(1)     -.066  .798   .178 .0167
O(2)     -.003  .814  -.095 .0175
O(3)      .185  .866  -.290 .0145
O(4)      .121  .840   .388 .0176
O(5)     -.328  .835  -.163 .0103
O(6)     -.091  .820  -.388 .0122
O(7)      .469  .848  -.364 .0192
OH(8)     .390  .597  -.548 .0166
O(9)      .387  .888  -.660 .0104
O(10)     .607  .842  -.883 .0095
O(11)     .601  .614  -.773 .0131
O(12)     .265  .654   .107 .0381
O(13)     .163  .594  -.336 .0197
O(14)     .704  .818  -.593 .0142
Wat(15)   .039  .552   .356 .0439
Wat(16)  -.131  .558  -.057 .0527
O(17)     .490  .645  -.177 .0169
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Juabite
Download hom/juabite.pdf
Kampf A R, Mills S J
 
Journal of Geosciences 56 (2011) 235-247
The role of hydrogen in tellurites: crystal structure refinements of juabite,
poughite and rodalquilarite
Locality: Gold Chain mine, Tintic district, Juab County, Utah, USA
_database_code_amcsd 0018499
8.9925 10.1291 8.9971 102.668 92.490 70.434 P-1
atom       x      y      z   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Ca        .5     .5      0  .0174  .0275  .0112  .0096  -.0015  -.0006  .0021
Cu1   .80847 .79847 .00221 .01053  .0082  .0178  .0067  -.0050 -.00123 .00412
Cu2   .29631 .84151 .51172 .00956  .0071  .0152  .0086  -.0056 -.00175  .0044
Cu3   .39218 .50715 .62469 .01284  .0124  .0114  .0135  -.0011   .0011  .0044
Cu4   .68366 .84877 .62919 .01128  .0077  .0217  .0072  -.0073 -.00098  .0049
Cu5  -.07412 .79869 .39124 .01257  .0085  .0242  .0073  -.0082 -.00112  .0039
Te1   .45602 .83827 .84848 .01031 .01015 .01328 .00919 -.00540  .00061 .00333
Te2   .12971 .83488 .17031 .01521 .01358 .02100 .01315 -.00748  .00011 .00520
As1   .06582 .77050 .72526 .00865 .00636  .0130 .00751 -.00388 -.00038 .00318
As2   .57354 .78999 .27256 .00731 .00623  .0102 .00642 -.00332 -.00031 .00284
O1     .9360  .7964  .1772  .0163  .0098  .0325  .0104  -.0104  -.0028  .0076
O2     .9955  .8138  .9048  .0173  .0123   .036  .0066  -.0120  -.0002  .0050
O3     .1835  .8663  .7093  .0134  .0109  .0192  .0120  -.0080   .0002  .0026
O4     .1208  .8388  .3848  .0154  .0104  .0314  .0097  -.0114  -.0031  .0088
O5     .6715  .8349  .8369  .0153  .0097  .0315  .0087  -.0091  -.0018  .0090
O6     .9079  .8216  .6126  .0133  .0077  .0264  .0064  -.0059  -.0009  .0045
O7     .4697  .8485  .6392  .0143  .0119  .0283  .0072  -.0104  -.0028  .0077
O8     .3907  .5973  .4521  .0147  .0136  .0145  .0149  -.0028  -.0017  .0043
H8      .316   .578   .394   .050
O9     .3879  .8893  .3402  .0112  .0061  .0155  .0122  -.0024   .0002  .0054
O10    .6056  .8444  .1173  .0126  .0095  .0204  .0100  -.0044  -.0007  .0082
O11    .5985  .6138  .2261  .0145  .0188  .0111  .0151  -.0060  -.0001  .0047
O12    .2642  .6526  .1042  .0306  .0201   .028   .032   .0003   .0017 -.0051
O13    .1627  .5943  .6638  .0207  .0134  .0134   .034  -.0023   .0010  .0052
O14    .7041  .8183  .4081  .0146  .0083  .0287  .0082  -.0088  -.0015  .0034
OW15   .0394  .5528  .3541  .0405   .045   .028   .049   -.017   -.010   .005
H15a   -.035   .513   .335   .050
H15b    .088   .544   .439   .050
OW16   .8644  .5590  .9418  .0489   .048   .024   .067   -.010   -.003   .000
H16a    .786   .533   .965   .050
H16b    .885   .537   .841   .050
O17    .4873  .6464  .8254  .0182  .0255  .0148  .0173  -.0095  -.0030  .0054
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Download in:

Multiple datasets can be concatenated into a single downloadable file by selecting the datasets and then clicking

Multiple datasets can be downloaded as individual files inside a ZIP archive by selecting the datasets and then clicking

Total number of retrieved datasets: 2
View in amc, download in amc

Return to AMCSD Home Page