American Mineralogist Crystal Structure Database

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Takovite
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Mills S J, Whitfield P S, Kampf A R, Wilson S A, Dipple G M, Raudsepp M, Favreau G
 
Journal of Geosciences 58 (2012) 273-279
Contribution to the crystallography of hydrotalcites:
the crystal structures of woodallite and takovite
Note: polytype 3R
Note: calculated chemical formula differs from expected
Locality: Agoudal mine, Bou Azzer district, Tazenakht, Morocco
_database_code_amcsd 0019806
3.0290 3.0290 22.5995 90 90 120 R-3m
atom    x    y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ni      0    0      0 .623 .0095  .0077  .0077  .0132 .00387      0      0
Al      0    0      0 .377 .0095  .0077  .0077  .0132 .00387      0      0
C     1/3  2/3  .4992  .17  .063   .074   .074   .040   .037      0      0
O1    1/3  2/3 .04374      .0160  .0178  .0178  .0124  .0089      0      0
O2   .168 .168     .5  .17  .036   .040   .040   .022   .015  .0006 -.0006
H     1/3  2/3  .0822       .019
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