American Mineralogist Crystal Structure Database

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Kanoite
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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 = 270 C
_database_code_amcsd 0006699
9.796 8.880 5.315 90 109.26 90 C2/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     0 .9041   1/4 .979  .65  .0084  .0075  .0078      0  .0017      0
MnM1     0 .9041   1/4 .021  .65  .0084  .0075  .0078      0  .0017      0
CaM2     0 .2740   1/4  .07 1.20  .0169  .0144  .0118      0  .0013      0
MnM2     0 .2740   1/4 .786 1.20  .0169  .0144  .0118      0  .0013      0
MgM2     0 .2740   1/4 .144 1.20  .0169  .0144  .0118      0  .0013      0
Si   .2935 .0905 .2592       .71  .0080  .0088  .0099 -.0010  .0028 -.0008
O1   .1190 .0882 .1510       .92  .0077   .013   .014 -.0001  .0031 -.0010
O2   .3699 .2502 .3402      1.29   .017   .012   .020 -.0047  .0068 -.0031
O3   .3538 .0060 .0420      1.64   .011   .030   .020  .0003  .0031  -.015
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