Calcite
Sitepu H, O'Connor B H, Li D
Journal of Applied Crystallography 38 (2005) 158-167
Comparative evaluation of the March and generalized spherical harmonic
preferred orientation models using X-ray diffraction data for molybdite
and calcite powders
Note: March model
Locality: synthetic
_database_code_amcsd 0012867
4.991 4.991 17.068 90 90 120 R-3c
atom    x y   z   Uiso
Ca      0 0   0 .01550
C       0 0 .25 .01771
O    .245 0 .25 .01771