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American Mineralogist Crystal Structure Database

1 matching records for this search.

Nastrophite
Download hom/nastrophite.pdf 
Baturin S V, Malinovskii Y A, Belov N V
Soviet Physics Doklady 26 (1981) 1023-1026
The crystal structure of nastrophite Na(Sr,Ba)[PO4]*9H2O
_database_code_amcsd 0015610
10.559 10.559 10.559 90 90 90 P2_13
atom     x     y     z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Na   .6765 .6765 .6765       2.5  .0054  .0054  .0054 -.0008 -.0008 -.0008
Sr   .0533 .0533 .0533  .94  1.5  .0033  .0033  .0033      0      0      0
Ba   .0533 .0533 .0533  .03  1.5  .0033  .0033  .0033      0      0      0
Ca   .0533 .0533 .0533  .03  1.5  .0033  .0033  .0033      0      0      0
P    .4243 .4243 .4243       1.4  .0032  .0032  .0032 -.0007 -.0007 -.0007
O4   .3402 .3402 .3402  .44  3.3
O5   .5544 .4472 .3595  .44  2.4
O6   .5573 .3780 .4768  .27  2.4
O7   .5189 .3142 .3982  .25  2.4
O8   .3850 .4100 .5600  .04
O9   .3100 .3900 .3400 .187
Ow1  .3991 .0835 .3464       2.7  .0071  .0058  .0051 -.0004 -.0008 -.0009
Ow2  .2892 .1332 .0466       2.5  .0043  .0076  .0061 -.0011 -.0004  .0011
Ow3  .5994 .2910 .1499       2.6  .0062  .0055  .0054  .0013  .0015  .0014
H1     .39   .18   .38
H2     .43   .09   .28
H3     .34   .09   .08
H4     .33   .23   .06
H5     .57   .21   .14
H6     .54   .33   .22


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