American Mineralogist Crystal Structure Database

1 matching records for this search.

PrMo6O12
 
Barrier N, Tortelier J, Gougeon P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=1600-5368&volume=57&spage=3
Acta Crystallographica E57 (2001) i3-i5
A new reduced molybdenum oxide with a hollandite-type structure, PrMo6O12
_database_code_amcsd 0010350
9.9147 9.9147 8.6508 90 90 90 I4/m
atom      x       y       z   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3) U(2,3)
Pr        0       0 -.20745 .00788 .00901 .00901 .00562       0       0      0
Mo1  .34033 -.81670 -.34174 .00648 .00547 .00510 .00887 -.00143 -.00238 .00218
Mo2  .33255 -.81617       0 .00494 .00505 .00513 .00464  .00037       0      0
O1    .4568  -.1706  -.3324  .0066  .0043  .0096  .0058  -.0006  -.0002 -.0006
O2    .1722  -.1305  -.3329  .0084  .0085  .0103  .0062  -.0024   .0005 -.0016
O3    .4631  -.1626       0  .0062  .0060  .0076  .0052  -.0010       0      0
O4    .1229   .1602       0  .0065  .0066  .0080  .0050   .0000       0      0
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