American Mineralogist Crystal Structure Database

1 matching records for this search.

NaKAl2O(AsO4)2
 
Ben Yahia H, Nilges T, Rodewald U C, Pottgen R
Materials Research Bulletin 45 (2010) 2017-2023
New arsenates (V) NaKAl2O(AsO4)2 and Na2KAl3(AsO4)4
Locality: Synthetic
_database_code_amcsd 0020627
8.2368 5.5228 17.0160 90 90 90 Pnma
atom      x      y      z   Uiso U(1,1) U(2,2) U(3,3) U(1,2)  U(1,3) U(2,3)
Na    .5896    .25 .36500  .0299  .0475  .0235  .0187      0  -.0045      0
K    .45218    .75 .23191  .0221  .0183  .0312  .0167      0  -.0049      0
Al1  .78193    .75 .06151  .0062  .0041  .0047  .0096      0  -.0005      0
Al2      .5      0      0  .0050  .0041  .0024  .0084 -.0002  -.0013  .0004
As1  .69010    .25 .14812 .00598 .00714 .00462 .00620      0 -.00132      0
As2  .17059    .75 .05973 .00560 .00356 .00547 .00776      0  .00105      0
O1    .5980    .25  .2332  .0189  .0221  .0263  .0085      0   .0046      0
O2    .8096  .0037 .13400  .0113  .0115  .0069  .0155  .0043  -.0052 -.0027
O3    .5424    .25 .07610  .0064  .0070  .0050  .0072      0  -.0033      0
O4    .2713 -.0001 .02605  .0081  .0056  .0042  .0146 -.0012   .0008  .0017
O5    .1696    .75  .1555  .0220  .0173   .045  .0041      0   .0008      0
O6    .9852    .75  .0198  .0097  .0034  .0104  .0153      0  -.0012      0
O7    .5571    .75 .06339  .0056  .0048  .0042  .0078      0  -.0016      0
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