Pyrope
Oberti R, Quartieri S, Dalconi M C, Boscherini F, Iezzi G, Boiocchi M,
Eeckhout S G
American Mineralogist 91 (2006) 1230-1239
Site preference and local geometry of Sc in garnets: Part I.
Multifarious mechanisms in the pyrope-grossular join
Locality: synthetic
Sample: prp
_database_code_amcsd 0004180
11.4940 11.4940 11.4940 90 90 90 Ia-3d
atom      x      y      z occ Biso B(1,1) B(2,2) B(3,3) B(1,2)  B(1,3)  B(2,3)
MgX    .125      0    .25 .90  .89 .00101 .00202 .00202      0       0  .00048
ScX    .125      0    .25 .10  .89 .00101 .00202 .00202      0       0  .00048
AlY       0      0      0      .47 .00089 .00089 .00089 .00001  .00001  .00001
SiT    .375      0    .25 .95  .40 .00073 .00077 .00077      0       0       0
MgT    .375      0    .25 .05  .40 .00073 .00077 .00077      0       0       0
O    .03290 .05061 .65349      .59 .00113 .00135 .00089 .00010 -.00015 -.00001