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Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
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Locality: synthetic |
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Note: FeTi50Bd |
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_database_code_amcsd 0004822 |
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8.4716 8.4716 8.4716 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0076 .0076 .0076 0 0 0 |
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FeM .5 .5 .5 .6935 .0067 .0067 .0067 -.00003 -.00003 -.00003 |
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TiM .5 .5 .5 .2925 .0067 .0067 .0067 -.00003 -.00003 -.00003 |
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AlM .5 .5 .5 .014 .0067 .0067 .0067 -.00003 -.00003 -.00003 |
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O .25797 .25797 .25797 .0109 .0109 .0109 -.0007 -.0007 -.0007 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
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Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
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Note: FeTi50C |
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_database_code_amcsd 0004823 |
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8.4875 8.4875 8.4875 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0098 .0098 .0098 0 0 0 |
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FeM .5 .5 .5 .678 .0088 .0088 .0088 -.00011 -.00011 -.00011 |
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TiM .5 .5 .5 .322 .0088 .0088 .0088 -.00011 -.00011 -.00011 |
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O .25827 .25827 .25827 .0128 .0128 .0128 -.0006 -.0006 -.0006 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
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Note: FeTi40A |
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_database_code_amcsd 0004824 |
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8.4972 8.4972 8.4972 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0093 .0093 .0093 0 0 0 |
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FeM .5 .5 .5 .6435 .0077 .0077 .0077 -.00020 -.00020 -.00020 |
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TiM .5 .5 .5 .3565 .0077 .0077 .0077 -.00020 -.00020 -.00020 |
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O .25855 .25855 .25855 .0128 .0128 .0128 -.0011 -.0011 -.0011 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
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Note: FeTi60A |
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_database_code_amcsd 0004825 |
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8.4975 8.4975 8.4975 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0073 .0073 .0073 0 0 0 |
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FeM .5 .5 .5 .655 .0058 .0058 .0058 -.00027 -.00027 -.00027 |
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TiM .5 .5 .5 .345 .0058 .0058 .0058 -.00027 -.00027 -.00027 |
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O .25917 .25917 .25917 .0108 .0108 .0108 -.0019 -.0019 -.0019 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi70A |
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_database_code_amcsd 0004826 |
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8.5052 8.5052 8.5052 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0130 .0130 .0130 0 0 0 |
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FeM .5 .5 .5 .624 .0115 .0115 .0115 -.00049 -.00049 -.00049 |
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TiM .5 .5 .5 .376 .0115 .0115 .0115 -.00049 -.00049 -.00049 |
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O .25947 .25947 .25947 .0165 .0165 .0165 -.0011 -.0011 -.0011 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
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Note: FeTi80Ac |
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_database_code_amcsd 0004827 |
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8.5059 8.5059 8.5059 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0075 .0075 .0075 0 0 0 |
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FeM .5 .5 .5 .6235 .0057 .0057 .0057 -.00025 -.00025 -.00025 |
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TiM .5 .5 .5 .3755 .0057 .0057 .0057 -.00025 -.00025 -.00025 |
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O .25924 .25924 .25924 .0111 .0111 .0111 -.0016 -.0016 -.0016 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTi80Af |
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_database_code_amcsd 0004828 |
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8.5079 8.5079 8.5079 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0075 .0075 .0075 0 0 0 |
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FeM .5 .5 .5 .622 .0057 .0057 .0057 -.00022 -.00022 -.00022 |
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TiM .5 .5 .5 .378 .0057 .0057 .0057 -.00022 -.00022 -.00022 |
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O .25912 .25912 .25912 .0113 .0113 .0113 -.0019 -.0019 -.0019 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib3 |
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_database_code_amcsd 0004829 |
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8.5139 8.5139 8.5139 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0075 .0075 .0075 0 0 0 |
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FeM .5 .5 .5 .6 .0054 .0054 .0054 -.00051 -.00051 -.00051 |
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TiM .5 .5 .5 .4 .0054 .0054 .0054 -.00051 -.00051 -.00051 |
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O .25980 .25980 .25980 .0113 .0113 .0113 -.0024 -.0024 -.0024 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib2 |
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_database_code_amcsd 0004830 |
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8.5220 8.5220 8.5220 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0073 .0073 .0073 0 0 0 |
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FeM .5 .5 .5 .5775 .0049 .0049 .0049 -.00058 -.00058 -.00058 |
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TiM .5 .5 .5 .4225 .0049 .0049 .0049 -.00058 -.00058 -.00058 |
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O .26025 .26025 .26025 .0110 .0110 .0110 -.0029 -.0029 -.0029 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib4 |
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_database_code_amcsd 0004831 |
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8.5274 8.5274 8.5274 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0117 .0117 .0117 0 0 0 |
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FeM .5 .5 .5 .546 .0092 .0092 .0092 -.00068 -.00068 -.00068 |
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TiM .5 .5 .5 .454 .0092 .0092 .0092 -.00068 -.00068 -.00068 |
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O .26065 .26065 .26065 .0156 .0156 .0156 -.0034 -.0034 -.0034 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib1c |
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_database_code_amcsd 0004832 |
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8.5307 8.5307 8.5307 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0077 .0077 .0077 0 0 0 |
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FeM .5 .5 .5 .535 .0051 .0051 .0051 -.00068 -.00068 -.00068 |
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TiM .5 .5 .5 .465 .0051 .0051 .0051 -.00068 -.00068 -.00068 |
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O .26077 .26077 .26077 .0119 .0119 .0119 -.0038 -.0038 -.0038 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Bosi F, Halenius U, Skogby H |
|
American Mineralogist 94 (2009) 181-189 |
|
Crystal chemistry of the magnetite-ulvospinel series |
|
Locality: synthetic |
|
Note: FeTib1b |
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_database_code_amcsd 0004833 |
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8.5322 8.5322 8.5322 90 90 90 *Fd3m |
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.125 .125 .125 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeT .125 .125 .125 .0104 .0104 .0104 0 0 0 |
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FeM .5 .5 .5 .5275 .0076 .0076 .0076 -.00071 -.00071 -.00071 |
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TiM .5 .5 .5 .4725 .0076 .0076 .0076 -.00071 -.00071 -.00071 |
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O .26074 .26074 .26074 .0143 .0143 .0143 -.0035 -.0035 -.0035 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
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Ulvospinel |
|
Yamanaka T, Kyono A, Nakamoto Y, Meng Y, Kharlamova S, Struzhkin V V, Mao H |
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American Mineralogist 98 (2013) 736-744 |
|
High-pressure phase transitions of Fe3-xTixO4 solid solution |
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up to 60 GPa correlated with electronic spin transition |
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Locality: synthetic |
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Note: P = 5.58 GPa |
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_database_code_amcsd 0019929 |
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8.4480 8.4480 8.4480 90 90 90 Fd3m |
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atom x y z occ |
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Fe1 0 0 0 |
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Ti2 .625 .625 .625 .5 |
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Fe2 .625 .625 .625 .5 |
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O .3858 .3858 .3858 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
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Ulvospinel |
|
Yamanaka T, Kyono A, Nakamoto Y, Meng Y, Kharlamova S, Struzhkin V V, Mao H |
|
American Mineralogist 98 (2013) 736-744 |
|
High-pressure phase transitions of Fe3-xTixO4 solid solution |
|
up to 60 GPa correlated with electronic spin transition |
|
Locality: synthetic |
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Note: P = 7 GPa |
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_database_code_amcsd 0019930 |
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8.521 8.521 8.521 90 90 90 Fd3m |
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atom x y z occ |
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Fe1 0 0 0 |
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Ti2 .625 .625 .625 .5 |
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Fe2 .625 .625 .625 .5 |
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O .3629 .3629 .3629 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
|
Ulvospinel |
|
Yamanaka T, Kyono A, Nakamoto Y, Meng Y, Kharlamova S, Struzhkin V V, Mao H |
|
American Mineralogist 98 (2013) 736-744 |
|
High-pressure phase transitions of Fe3-xTixO4 solid solution |
|
up to 60 GPa correlated with electronic spin transition |
|
Locality: synthetic |
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Note: P = 14 GPa |
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_database_code_amcsd 0019931 |
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5.9052 5.9052 8.1834 90 90 90 *I4_1/amd |
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0 -.25 .125 |
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atom x y z |
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Fe1 0 0 .5 |
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Ti2 0 .75 .125 |
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O 0 .0293 .2522 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
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Ulvospinel |
|
Yamanaka T, Kyono A, Nakamoto Y, Meng Y, Kharlamova S, Struzhkin V V, Mao H |
|
American Mineralogist 98 (2013) 736-744 |
|
High-pressure phase transitions of Fe3-xTixO4 solid solution |
|
up to 60 GPa correlated with electronic spin transition |
|
Locality: synthetic |
|
Note: P = 50 GPa |
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_database_code_amcsd 0019932 |
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2.685 9.228 9.099 90 90 90 Cmcm |
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atom x y z occ |
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Fe1 0 .396 .25 |
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Ti2 0 .133 .068 .5 |
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Fe2 0 .133 .068 .5 |
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O1 0 .109 .25 |
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O2 0 .261 .623 |
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O3 0 .5 0 |
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| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure (permalink) |
  |
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