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American Mineralogist Crystal Structure Database

1 matching records for this search.

Ca3 Mn3 O8.02
  
Nguyen N, Calage Y, Varret F, Ferey G, Caignaert V, Hervieu M, Raveau B
Journal of Solid State Chemistry 53 (1984) 398-405
The oxygen defect Perovskite Ca3 Mn1.35 Fe1.65 O8.02: a highly
frustrated antiferromagnet
_cod_database_code 1000194
_database_code_amcsd 0013529
5.332 11.13 5.455 90 90 90 Pm2a
atom    x    y    z occ
Ca1   .25   .5  .75
Ca2   .24 .183   .7  .5
Ca3   .24 .834   .7  .5
Mn1   .27 .332 .259  .5
Mn2   .25 .665 .255
Mn3  .232    0 .237  .5
O1      0 .329    0
O2      0 .665    0
O3      0  .33   .5
O4      0  .66   .5
O5    .25   .5  .25  .7
O6    .25  .17  .25
O7    .25 .829  .25
O8      0  .01    0
O9      0  .01   .5  .3


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