Siderite
Graf D L
American Mineralogist 46 (1961) 1283-1316
Crystallographic tables for the rhombohedral carbonates
Locality: synthetic
_database_code_amcsd 0000101
4.6887 4.6887 15.373 90 90 120 R-3c
atom x y z
Fe 0 0 0
C 0 0 .25
O .2743 0 .25
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Siderite
Liang W, Yin Y, Li Z, Li R, Li L, He Y, Dong H, Li Z, Yan S, Zhai S, Li H
Physics and Chemistry of Minerals 45 (2018) 831-842
Single crystal growth, crystalline structure investigation and
high-pressure behavior of impurity-free siderite (FeCO3)
Locality: synthetic
_database_code_amcsd 0021224
4.6861 4.6861 15.362 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)
Fe 0 0 0 .0021 .0021 .0025 .0010 0 0
C 0 0 .25 .004 .004 .003 .0021 0 0
O .2757 0 .25 .0017 .0047 .0064 .0024 -.0007 -.0014
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Siderite
Effenberger H, Mereiter K, Zemann J
Zeitschrift fur Kristallographie 156 (1981) 233-243
Crystal structure refinements of magnesite, calcite, rhodochrosite, siderite,
smithsonite, and dolomite, with discussion of some aspects of the
stereochemistry of calcite type carbonates
Locality: Ivigtut, Greenland
_database_code_amcsd 0020837
4.6916 4.6916 15.3796 90 90 120 R-3c
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Fe 0 0 0 .95 .00580 .00580 .00514 .00290 0 0
Mn 0 0 0 .05 .00580 .00580 .00514 .00290 0 0
C 0 0 .25 .00571 .00571 .00511 .002855 0 0
O .27427 0 .25 .00586 .00850 .00915 .00425 -.00077 -.00154
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P0, P = 0.02 GPa
_database_code_amcsd 0017561
4.694 4.694 15.43 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0062
C 0 0 .25 .005
O .2745 0 .25 .006
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P1, P = 1.89 GPa
_database_code_amcsd 0017562
4.676 4.676 15.310 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0086
C 0 0 .25 .005
O .2741 0 .25 . 010
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P2, P = 3.48 GPa
_database_code_amcsd 0017563
4.664 4.664 15.168 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .008
C 0 0 .25 .005
O .273 0 .25 .009
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P3, P = 4.89 GPa
_database_code_amcsd 0017564
4.650 4.650 15.12 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .010
C 0 0 .25 .005
O .275 0 .25 .012
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P4, P = 7.31 GPa
_database_code_amcsd 0017565
4.637 4.637 14.98 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .009
C 0 0 .25 .005
O .278 0 .25 .004
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P5, P = 14.4 GPa
_database_code_amcsd 0017566
4.607 4.607 14.415 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0090
C 0 0 .25 .005
O .2764 0 .25 .0101
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P6, P = 18.37 GPa
_database_code_amcsd 0017567
4.587 4.587 14.258 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0092
C 0 0 .25 .005
O .2779 0 .25 .0115
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P7, P = 18.82 GPa
_database_code_amcsd 0017568
4.575 4.575 14.29 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0075
C 0 0 .25 .005
O .2777 0 .25 .0095
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Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P8, P = 19.19 GPa
_database_code_amcsd 0017569
4.579 4.579 14.28 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0093
C 0 0 .25 .005
O .2779 0 .25 .0109
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P9, P = 28.62 GPa
_database_code_amcsd 0017570
4.548 4.548 13.89 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0089
C 0 0 .25 .005
O .2787 0 .25 .0091
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P10, P = 30.6 GPa
_database_code_amcsd 0017571
4.539 4.539 13.80 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0092
C 0 0 .25 .005
O .2795 0 .25 .0093
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P11, P = 36.3 GPa
_database_code_amcsd 0017572
4.527 4.527 13.57 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0090
C 0 0 .25 .005
O .2788 0 .25 .011
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P12, P = 38.5 GPa
_database_code_amcsd 0017573
4.519 4.519 13.47 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0098
C 0 0 .25 .005
O .2779 0 .25 .011
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P13-1, P = 39.05 GPa
_database_code_amcsd 0017574
4.523 4.523 13.40 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .009
C 0 0 .25 .005
O .2800 0 .25 .009
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P13-2, P = 39.0 GPa
_database_code_amcsd 0017575
4.518 4.518 13.457 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0106
C 0 0 .25 .005
O .2780 0 .25 .011
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P14, P = 41.2 GPa
_database_code_amcsd 0017576
4.514 4.514 13.34 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0088
C 0 0 .25 .005
O .278 0 .25 .010
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P15, P = 43.9 GPa
_database_code_amcsd 0017577
4.502 4.502 13.23 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0091
C 0 0 .25 .005
O .2788 0 .25 .012
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P16, P = 44.14 GPa
_database_code_amcsd 0017578
4.500 4.500 13.25 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .007
C 0 0 .25 .005
O .280 0 .25 .005
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P18_HS, P = 45.13 GPa
_database_code_amcsd 0017579
4.485 4.485 13.19 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0115
C 0 0 .25 .005
O .2811 0 .25 .009
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P19, P = 46.4 GPa
_database_code_amcsd 0017580
4.367 4.367 12.78 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0059
C 0 0 .25 .005
O .2884 0 .25 .0058
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P20-1, P = 46.92 GPa
_database_code_amcsd 0017581
4.372 4.372 12.72 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0074
C 0 0 .25 .005
O .2892 0 .25 .0080
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P20-2, P = 47.2 GPa
_database_code_amcsd 0017582
4.368 4.368 12.75 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0041
C 0 0 .25 .005
O .2875 0 .25 .0051
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P21, P = 47.49 GPa
_database_code_amcsd 0017583
4.367 4.367 12.74 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0053
C 0 0 .25 .005
O .2885 0 .25 .0058
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P22, P = 49.2 GPa
_database_code_amcsd 0017584
4.364 4.364 12.66 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0055
C 0 0 .25 .005
O .2883 0 .25 .007
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P23, P = 51.9 GPa
_database_code_amcsd 0017585
4.355 4.355 12.59 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0064
C 0 0 .25 .005
O .2890 0 .25 .004
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P24, P = 52.6 GPa
_database_code_amcsd 0017586
4.358 4.358 12.62 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0070
C 0 0 .25 .005
O .2901 0 .25 .008
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P25, P = 54.0 GPa
_database_code_amcsd 0017587
4.355 4.355 12.54 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0075
C 0 0 .25 .005
O .2898 0 .25 .009
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P26, P = 55.96 GPa
_database_code_amcsd 0017588
4.343 4.343 12.497 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0053
C 0 0 .25 .005
O .2901 0 .25 .0047
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P27-1, P = 55.0 GPa
_database_code_amcsd 0017589
4.3474 4.3474 12.534 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .010
C 0 0 .25 .005
O .2887 0 .25 .011
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P27-2, P = 55.0 GPa
_database_code_amcsd 0017590
4.3462 4.3462 12.519 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0078
C 0 0 .25 .005
O .2904 0 .25 .009
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P27-3, P = 55.0 GPa
_database_code_amcsd 0017591
4.3480 4.3480 12.52 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .0096
C 0 0 .25 .005
O .2886 0 .25 .0093
Download AMC data (View Text File )Download CIF data (View Text File )Download diffraction data (View Text File )View JMOL 3-D Structure (permalink )
Siderite
Lavina B, Dera P, Downs R T, Yang W, Sinogeikin S, Meng Y, Shen G, Schiferl D
Physical Review B82 (2010) 064110-8
Structure of siderite FeCO3 to 56 GPa and hysteresis of its spin-pairing transition
Locality: Invigtut, Greenland
Note: run P27-4, P = 55.0 GPa
_database_code_amcsd 0017592
4.347 4.347 12.477 90 90 120 R-3c
atom x y z Uiso
Fe 0 0 0 .007
C 0 0 .25 .005
O .2896 0 .25 .009
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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