American Mineralogist Crystal Structure Database

1 matching records for this search.

Chlormayenite
 
Bartl H, Scheller T
Neues Jahrbuch fur Mineralogie, Monatshefte 1970 (1970) 547-552
Zur struktur des 12CaO*7Al2O3
Locality: synthetic
_database_code_amcsd 0014739
11.989 11.989 11.989 90 90 90 I-43d
atom     x     y     z  occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Ca       0   .25 .1397       .0015  .0015  .0019  .0001      0      0
Al1  .0187 .0187 .0187       .0010  .0010  .0010  .0000  .0000  .0000
Al2  -.125     0   .25       .0006  .0007  .0007      0      0      0
O1    .151 -.037  .057       .0018  .0017  .0014  .0009  .0003  .0004
O2   -.064 -.064 -.064       .0013  .0013  .0013  .0000  .0000  .0000
O3    .337     0   .25 .083   .003   .001   .002      0      0   .001
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