American Mineralogist Crystal Structure Database

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Diopside
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Bindi L, Safonov O G, Litvin Y A, Perchuk L L, Menchetti S
European Journal of Mineralogy 14 (2002) 929-934
Ultrahigh potassium content in the clinopyroxene structure:
an X-ray single-crystal study
Sample: K2
_database_code_amcsd 0006948
9.744 8.904 5.273 90 106.14 90 C2/c
atom      x      y      z  occ   Uiso U(1,1) U(2,2) U(3,3)  U(1,2)  U(1,3)  U(2,3)
CaM2      0 .30054    1/4 .896 .01247 .01239 .01323 .00969       0 -.00044       0
MgM2      0 .30054    1/4 .032 .01247 .01239 .01323 .00969       0 -.00044       0
KM2       0 .30054    1/4 .072 .01247 .01239 .01323 .00969       0 -.00044       0
MgM1      0 .90677    1/4 .855 .00941 .00957 .00971 .00863       0  .00203       0
AlM1      0 .90677    1/4 .145 .00941 .00957 .00971 .00863       0  .00203       0
SiT  .28775 .09247 .23260 .968 .00678 .00612 .00818 .00630 -.00033  .00214  .00084
AlT  .28775 .09247 .23260 .032 .00678 .00612 .00818 .00630 -.00033  .00214  .00084
O1   .11522 .08746 .14715      .00912 .00537 .01121 .01081  .00098  .00230  .00095
O2   .36290 .24918 .32315      .01182 .01243 .01013 .01396 -.00361  .00544  .00036
O3   .34501 .01882 .98670      .01126 .01030 .01444 .00898  .00242  .00258 -.00340
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