American Mineralogist Crystal Structure Database

1 matching records for this search.

Bi0.4Fe3P3O13
 
Benabad A, Bakhous K, Cherkaoui F, Holt E
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=56&spage=1292
Acta Crystallographica C56 (2000) 1292-1293
Bismuth(V) iron(III) tris(phosphate) oxide
_cod_database_code 1100910
_database_code_amcsd 0018276
7.4960 6.3080 10.125 90.00 100.110 90.00 P2_1/m
atom     x     y       z occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Bi1  .6591   .25  .19371  .4 .0114  .0118  .0106  .0121      0  .0033      0
Fe1      0     0       0     .0070  .0078  .0038  .0098 -.0015  .0030 -.0002
Fe2  .6496   .25 -.20185     .0060  .0051  .0052  .0078      0  .0018      0
Fe3  .2143   .25 -.43654     .0081  .0107  .0064  .0074      0  .0020      0
O1   .8762   .25  -.0928     .0088   .013   .008   .003      0  -.004      0
P1   .7834   .25   .5116     .0072  .0109  .0045  .0075      0  .0051      0
O11  .9749   .25   .5901     .0120   .009   .015   .011      0  -.002      0
O12  .6511   .25   .6076     .0129   .010   .021   .008      0   .001      0
O13  .7512 .0608   .4154     .0113   .020   .005   .009   .002   .003   .002
P2   .3173   .25  -.1129     .0061  .0074  .0049  .0076      0  .0059      0
O21  .3585   .25  -.2563     .0060   .002   .010   .006      0   .000      0
O22  .5078   .25  -.0310     .0091   .013   .011   .002      0  -.001      0
O23  .2109 .0486  -.0936     .0088   .011   .006   .011   .002   .004   .002
P3   .2634   .25   .2394     .0064  .0091  .0039  .0064      0  .0023      0
O31  .2150   .25   .3744     .0161   .022   .020   .008      0   .006      0
O32  .0829   .25   .1343     .0083   .022   .020   .007      0   .006      0
O33  .3797 .4374   .2129     .0093   .010   .005   .013   .000   .003   .001
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