|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 0 |
|
_database_code_amcsd 0002400 |
|
8.3965 8.3965 8.3965 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2549 .2549 .2549 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 1.4 GPa |
|
_database_code_amcsd 0002401 |
|
8.3837 8.3837 8.3837 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2554 .2554 .2554 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 2.3 GPa |
|
_database_code_amcsd 0002402 |
|
8.3685 8.3685 8.3685 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2550 .2550 .2550 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 3.4 GPa |
|
_database_code_amcsd 0002403 |
|
8.3517 8.3517 8.3517 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2548 .2548 .2548 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 6.6 GPa |
|
_database_code_amcsd 0002404 |
|
8.3122 8.3122 8.3122 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2549 .2549 .2549 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 8.3 GPa |
|
_database_code_amcsd 0002405 |
|
8.2966 8.2966 8.2966 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2549 .2549 .2549 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 11.3 GPa |
|
_database_code_amcsd 0002406 |
|
8.2626 8.2626 8.2626 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2549 .2549 .2549 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 12.5 GPa |
|
_database_code_amcsd 0002407 |
|
8.2547 8.2547 8.2547 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2547 .2547 .2547 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 13.5 GPa |
|
_database_code_amcsd 0002408 |
|
8.2396 8.2396 8.2396 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2543 .2543 .2543 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 15.7 GPa |
|
_database_code_amcsd 0002409 |
|
8.2321 8.2321 8.2321 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2548 .2548 .2548 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 17.5 GPa |
|
_database_code_amcsd 0002410 |
|
8.2140 8.2140 8.2140 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2552 .2552 .2552 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 19.4 GPa |
|
_database_code_amcsd 0002411 |
|
8.1891 8.1891 8.1891 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2555 .2555 .2555 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 21.8 GPa |
|
_database_code_amcsd 0002412 |
|
8.1710 8.1710 8.1710 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2553 .2553 .2553 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 24.2 GPa |
|
_database_code_amcsd 0002413 |
|
8.1509 8.1509 8.1509 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2554 .2554 .2554 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 26.9 GPa |
|
_database_code_amcsd 0002414 |
|
8.1177 8.1177 8.1177 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2549 .2549 .2549 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at P = 30.3 GPa |
|
_database_code_amcsd 0002415 |
|
8.0636 8.0636 8.0636 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe(tet) .125 .125 .125 |
|
Fe(oct) .5 .5 .5 |
|
O .2527 .2527 .2527 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite-h |
| |
Haavik C, Stolen S, Fjellvag H, Hanfland M, Hausermann D |
 |
American Mineralogist 85 (2000) 514-523 |
|
Equation of state of magnetite and its high-pressure modification: |
|
Thermodynamics of the Fe-O system at high pressure |
|
Sample at 40 GPa, CaTi2O4 structure type |
|
_database_code_amcsd 0002416 |
|
9.273 9.239 2.746 90 90 90 Bbmm |
|
atom x y z |
|
Fe1 .375 .25 0 |
|
Fe2(oct) .135 .087 0 |
|
O1 .005 .25 0 |
|
O2 .214 .605 0 |
|
O3 .5 0 0 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Wustite |
 |
Fjellvag H, Hauback B C, Vogt T, Stolen S |
 |
American Mineralogist 87 (2002) 347-349 |
|
Monoclinic nearly stoichiometric wustite at low temperatures |
|
Sample: BNL, T = 10 K |
|
_database_code_amcsd 0002758 |
|
5.2615 3.0334 3.0602 90 124.649 90 C2/m |
|
atom x y z occ |
|
Fe 0 0 0 .99 |
|
O 0 1/2 1/2 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Wustite |
 |
Fjellvag H, Hauback B C, Vogt T, Stolen S |
 |
American Mineralogist 87 (2002) 347-349 |
|
Monoclinic nearly stoichiometric wustite at low temperatures |
|
Sample: Kjeller, T = 8 K |
|
_database_code_amcsd 0002759 |
|
5.2642 3.0327 3.0626 90 124.646 90 C2/m |
|
atom x y z occ |
|
Fe 0 0 0 .99 |
|
O 0 1/2 1/2 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Iron |
 |
Fjellvag H, Hauback B C, Vogt T, Stolen S |
 |
American Mineralogist 87 (2002) 347-349 |
|
Monoclinic nearly stoichiometric wustite at low temperatures |
|
Sample: BNL, T = 10 K |
|
_database_code_amcsd 0002760 |
|
2.855 2.855 2.855 90 90 90 Im3m |
|
atom x y z |
|
Fe 0 0 0 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Iron |
 |
Fjellvag H, Hauback B C, Vogt T, Stolen S |
 |
American Mineralogist 87 (2002) 347-349 |
|
Monoclinic nearly stoichiometric wustite at low temperatures |
|
Sample: Kjeller, T = 8 K |
|
_database_code_amcsd 0002761 |
|
2.8604 2.8604 2.8604 90 90 90 Im3m |
|
atom x y z |
|
Fe 0 0 0 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Fjellvag H, Hauback B C, Vogt T, Stolen S |
 |
American Mineralogist 87 (2002) 347-349 |
|
Monoclinic nearly stoichiometric wustite at low temperatures |
|
Sample: BNL, T = 10 K |
|
_database_code_amcsd 0002762 |
|
8.3851 8.3851 8.3851 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z Biso |
|
FeA .125 .125 .125 0.37 |
|
FeB .5 .5 .5 0.47 |
|
O .2534 .2534 .2534 0.64 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Fjellvag H, Hauback B C, Vogt T, Stolen S |
 |
American Mineralogist 87 (2002) 347-349 |
|
Monoclinic nearly stoichiometric wustite at low temperatures |
|
Sample: Kjeller, T = 8 K |
|
_database_code_amcsd 0002763 |
|
8.3858 8.3858 8.3858 90 90 90 *Fd3m |
|
.125 .125 .125 |
|
atom x y z Biso |
|
FeA .125 .125 .125 0.37 |
|
FeB .5 .5 .5 0.47 |
|
O .2548 .2548 .2548 0.64 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Covellite |
 |
Fjellvag H, Gronvold F, Stolen S, Andresen A F, Mueller-Kaefer R, Simon A |
 |
Zeitschrift fur Kristallographie 184 (1988) 111-121 |
|
Low-temperature structural distortion in CuS |
|
Locality: synthetic |
|
Sample: T = 295 K |
|
_database_code_amcsd 0010979 |
|
3.7917 3.7917 16.342 90 90 120 P6_3/mmc |
|
atom x y z |
|
Cu1 1/3 2/3 .75 |
|
Cu2 1/3 2/3 .1072 |
|
S1 1/3 2/3 .25 |
|
S2 0 0 .0611 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Covellite |
 |
Fjellvag H, Gronvold F, Stolen S, Andresen A F, Mueller-Kaefer R, Simon A |
 |
Zeitschrift fur Kristallographie 184 (1988) 111-121 |
|
Low-temperature structural distortion in CuS |
|
Locality: synthetic |
|
Sample: T = 55 K |
|
Note: Cell parameters estimated from Figure 1 |
|
_database_code_amcsd 0010980 |
|
3.782 3.782 16.29 90 90 120 P6_3/mmc |
|
atom x y z |
|
Cu1 1/3 2/3 .75 |
|
Cu2 1/3 2/3 .1068 |
|
S1 1/3 2/3 .25 |
|
S2 0 0 .0624 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Covellite |
 |
Fjellvag H, Gronvold F, Stolen S, Andresen A F, Mueller-Kaefer R, Simon A |
 |
Zeitschrift fur Kristallographie 184 (1988) 111-121 |
|
Low-temperature structural distortion in CuS |
|
Locality: synthetic |
|
Sample: T = 8 K |
|
Note: Cell parameters estimated from Figure 1 |
|
_database_code_amcsd 0010981 |
|
3.763 6.568 16.225 90 90 90 Cmcm |
|
atom x y z Biso |
|
Cu1 0 .3623 .75 .2 |
|
Cu2 0 .3372 .1070 .2 |
|
S1 0 .3068 .25 .35 |
|
S2 0 .0008 .0627 .35 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Langisite |
 |
Fjellvag H, Selte K, Stave F E |
|   |
Acta Chemica Scandinavica A38 (1984) 687-691 |
|
On the structural and magnetic properties of Co1-tNitAs and CoAs1-xSbx |
|
_database_code_amcsd 0011969 |
|
5.16 3.54 5.87 90 90 90 Pnma |
|
atom x y z occ |
|
Co .0051 .25 .2009 |
|
As .2026 .25 .5849 .95 |
|
Sb .2026 .25 .5849 .05 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Langisite |
 |
Fjellvag H, Selte K, Stave F E |
|   |
Acta Chemica Scandinavica A38 (1984) 687-691 |
|
On the structural and magnetic properties of Co1-tNitAs and CoAs1-xSbx |
|
Locality: synthetic |
|
_database_code_amcsd 0011970 |
|
5.16 3.54 5.87 90 90 90 Pnma |
|
atom x y z occ |
|
Co .0111 .25 .2049 .9 |
|
Ni .0111 .25 .2049 .1 |
|
As .2117 .25 .5700 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Wustite |
 |
Fjellvag H, Gronvold F, Stolen S, Hauback B C |
|   |
Journal of Solid State Chemistry 124 (1996) 52-57 |
|
On the crystallographic and magnetic structures of |
|
nearly stoichiometric iron monoxide |
|
Locality: synthetic |
|
Sample: Three-Phase Mixture FeO, T = 298 K |
|
_database_code_amcsd 0013893 |
|
4.326 4.326 4.326 90 90 90 Fm-3m |
|
atom x y z |
|
Fe 0 0 0 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Wustite |
 |
Fjellvag H, Gronvold F, Stolen S, Hauback B C |
|   |
Journal of Solid State Chemistry 124 (1996) 52-57 |
|
On the crystallographic and magnetic structures of |
|
nearly stoichiometric iron monoxide |
|
Locality: synthetic |
|
Sample: Single-Phase Fe0.925O, T = 298 K |
|
_database_code_amcsd 0013894 |
|
4.3064 4.3064 4.3064 90 90 90 Fm-3m |
|
atom x y z occ |
|
Fe1 0 0 0 .870 |
|
Fe2 .25 .25 .25 .0275 |
|
O .5 .5 .5 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Fjellvag H, Gronvold F, Stolen S, Hauback B C |
|   |
Journal of Solid State Chemistry 124 (1996) 52-57 |
|
On the crystallographic and magnetic structures of |
|
nearly stoichiometric iron monoxide |
|
Locality: synthetic |
|
Sample: T = 298 K |
|
_database_code_amcsd 0013895 |
|
8.4045 8.4045 8.4045 90 90 90 *Fd-3m |
|
.125 .125 .125 |
|
atom x y z |
|
Fe1 .875 .875 .875 |
|
Fe2 .5 .5 .5 |
|
O .2542 .2542 .2542 |
|
|
| Download AMC data (View Text File) Download CIF data (View Text File) Download diffraction data (View Text File) View JMOL 3-D Structure
|
|   |
|
Magnetite |
 |
Fjellvag H, Gronvold F, Stolen S, Hauback B C |
|   |
Journal of Solid State Chemistry 124 (1996) 52-57 |
|
On the crystallographic and magnetic structures of |
|
nearly stoichiometric iron monoxide |
|
Locality: synthetic |
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Sample: T = 12 K |
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_database_code_amcsd 0013896 |
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8.3873 8.3873 8.3873 90 90 90 *Fd-3m |
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.125 .125 .125 |
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atom x y z |
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Fe1 .875 .875 .875 |
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Fe2 .5 .5 .5 |
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O .2547 .2547 .2547 |
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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
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Wustite |
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Fjellvag H, Gronvold F, Stolen S, Hauback B C |
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Journal of Solid State Chemistry 124 (1996) 52-57 |
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On the crystallographic and magnetic structures of |
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nearly stoichiometric iron monoxide |
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Locality: synthetic |
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Note: low-temperature polymorph |
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Sample: Three-Phase Mixture FeO, T = 12 K |
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_database_code_amcsd 0013897 |
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6.132 6.132 6.132 59.34 59.34 59.34 R-3 |
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atom x y z |
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Fe1 0 0 0 |
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Fe2 .5 .5 .5 |
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Fe3 .5 0 0 |
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Fe4 0 .5 .5 |
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O1 .25 .25 .25 |
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O2 .25 .25 .75 |
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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
|
|   |
|
Wustite |
 |
Fjellvag H, Gronvold F, Stolen S, Hauback B C |
|   |
Journal of Solid State Chemistry 124 (1996) 52-57 |
|
On the crystallographic and magnetic structures of |
|
nearly stoichiometric iron monoxide |
|
Locality: synthetic |
|
Note: low-temperature polymorph |
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Sample: Single-Phase Fe0.925O, T = 12 K |
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_database_code_amcsd 0013898 |
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6.073 6.073 6.073 59.92 59.92 59.92 R-3 |
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atom x y z occ |
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Fe1 0 0 0 .870 |
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Fe2 .5 .5 .5 .870 |
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Fe3 .5 0 0 .870 |
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Fe4 0 .5 .5 .870 |
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Fe5 .125 .125 .125 .0275 |
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Fe6 .625 .625 .625 .0275 |
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Fe7 .125 .625 .625 .0275 |
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Fe8 .625 .125 .125 .0275 |
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O1 .25 .25 .25 |
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O2 .25 .25 .75 |
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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
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