American Mineralogist Crystal Structure Database

1 matching records for this search.

Caysichite-(Y)
Download hom/caysichitey.pdf
Mellini M, Merlino S
Download cm/vol16/CM16_81.pdf
The Canadian Mineralogist 16 (1978) 81-88
Caysichite: A double crankshaft chain structure
_database_code_amcsd 0005150
13.27 13.91 9.73 90 90 90 Ccm2_1
atom      x     y      z occ Biso B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Y     .1403 .1710  .0422          .00091 .00147 .00289  .00021 -.00013  .00052
Ca    .1471 .1647  .4574 .75      .00117 .00198 .00320 -.00040  .00026 -.00058
Y     .1471 .1647  .4574 .25      .00117 .00198 .00320 -.00040  .00026 -.00058
Si1   .3990 .1103  .0880          .00056 .00021 .00091 -.00010 -.00041  .00009
Si2   .4069 .1118  .4039          .00018 .00015 .00017 -.00007  .00007  .00002
O1    .3672     0  .0618          .00085 .00002 .00021       0 -.00051       0
O2    .3774     0  .4311          .00129 .00128 .00133       0  .00141       0
O3    .4390 .1228  .2457          .00130 .00072 .00101 -.00031 -.00103 -.00029
O4    .3092 .1808  .0559          .00042 .00099 .00146       0  .00019  .00077
O5    .3187 .1831  .4555          .00106 .00071 .00212  .00049 -.00030 -.00079
O6    .4953 .1382 -.0054          .00133 .00230 .00224  .00038  .00115 -.00077
Wat12 .1520 .2780  .2482          .00126 .00106 .00255 -.00021  .00118  .00005
Wat13 .3478     0  .7445          .00850 .00940 .01650       0 -.00950       0
Wat14 .1698     0  .5297 .50      .00700 .00090 .00580       0  .00360       0
OH14  .1698     0  .5297 .50      .00700 .00090 .00580       0  .00360       0
C1    .0681 .1527  .7562      .89
C2    .1622     0  .1851      .68
O7    .1632 .1381  .7701     2.41
O8    .0226 .1597  .6407     1.26
O9    .0200 .1635  .8693     1.09
O10   .1391     0  .0583     1.59
O11   .1721 .0809  .2538      .69
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