Kanoite
Arlt T, Armbruster T
European Journal of Mineralogy 9 (1997) 953-964
The temperature-dependent P2_1/c - C2/c phase transition in the
clinopyroxene kanoite MnMg[Si2O6]: a single-crystal X-ray and optical study
T = 200 C
_database_code_amcsd 0006698
9.758 8.897 5.283 90 108.74 90 P2_1/c
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 .2506  .6539 .2367 .969  .48  .0063  .0064  .0057   .001  .0019  .0006
MnM1 .2506  .6539 .2367 .031  .48  .0063  .0064  .0057   .001  .0019  .0006
CaM2 .2531 .02387 .2353  .07  .95  .0128  .0126  .0093  .0017  .0014  .0010
MnM2 .2531 .02387 .2353 .790  .95  .0128  .0126  .0093  .0017  .0014  .0010
MgM2 .2531 .02387 .2353 .140  .95  .0128  .0126  .0093  .0017  .0014  .0010
SiA  .0420  .3410 .2693       .56  .0059  .0073  .0080 -.0005  .0023 -.0007
SiB  .5462  .8391 .2426       .58  .0070  .0078  .0079 -.0012  .0031 -.0009
O1A  .8670  .3376 .1629       .69   .006   .012   .009   .000   .003   .000
O1B  .3712  .8377 .1370       .72   .005   .011   .010  -.001   .002   .000
O2A  .1182  .5021 .3265       .89   .012   .008   .014  -.004   .005  -.002
O2B  .6239  .9942 .3571      1.13   .015   .013   .015   .004   .004   .010
O3A  .1043  .2586 .5661       .99   .007   .015   .015   .004   .004   .010
O3B  .6046  .7199 .4984      1.03   .011   .018   .012   .000   .006   .006