American Mineralogist Crystal Structure Database

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Download hom/corundum.pdf
Lewis J, Schwarzenbach D, Flack H D
Acta Crystallographica A38 (1982) 733-739
Electric field gradients and charge density in corundum alpha-Al2O3
_database_code_amcsd 0009325
4.7602 4.7602 12.9933 90 90 120 R-3c
atom      x y      z U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3) U(2,3)
Al        0 0 .35216 .00279 .00279 .00296 .001395      0      0
O    .30624 0    .25 .00327 .00341 .00365 .001635 .00047 .00094
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