Forsterite
Heuer M
Journal of Applied Crystallography 34 (2001) 271-279
The determination of site occupancies using a new strategy in Rietveld refinements
Note: results of the conventional refinement on single-crystal data
Locality: synthetic
_database_code_amcsd 0020682
4.762 10.235 5.998 90 90 90 Pbnm
atom      x      y      z  occ  Biso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
MgM1      0      0      0 .881 .8188 .00937  .0123 .00944      0      0      0
FeM1      0      0      0 .119 .8188 .00937  .0123 .00944      0      0      0
MgM2 .98952 .27772    .25 .889 .8075 .01074 .00982 .01015 .00025      0      0
FeM2 .98952 .27772    .25 .111 .8075 .01074 .00982 .01015 .00025      0      0
Si   .42700 .09441    .25      .6895 .00757 .00966 .00895 .00000      0      0
O1    .7659 .09158    .25      .7958  .0079  .0121  .0102  .0002      0      0
O2    .2206 .44799    .25      .7912  .0098  .0093  .0109  .0000      0      0
O3   .27844 .16333 .03345      .8418  .0098  .0122  .0101 -.0001 -.0003 .00165