American Mineralogist Crystal Structure Database

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Ilmenite
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Yamanaka T, Komatsu Y, Nomori H
 
Physics and Chemistry of Minerals 34 (2007) 307-318
Electron density distribution of FeTiO3 ilmenite under high pressure analyzed
by MEM using single crystal diffraction intensities
Locality: synthetic
Sample: P = 1 atm
_database_code_amcsd 0009082
5.08810 5.08810 14.0910 90 90 120 R-3
atom      x      y       z Biso U(1,1) U(2,2)  U(3,3) U(1,2)  U(1,3)  U(2,3)
Fe        0      0 .355430 .457 .00582 .00582 .005732 .00291       0       0
Ti        0      0 .146429 .352 .00433 .00433 .004709 .00217       0       0
O    .31717 .02351  .24498  .48  .0050  .0057 .006784 .00209 .000221 .001462
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