Cohenite
Herbstein F H, Smuts J
Acta Crystallographica 17 (1964) 1331-1332
Comparison of X-ray and neutron-diffraction refinements
of the structure of cementite Fe3C
Locality: synthetic
_database_code_amcsd 0019097
5.090 6.748 4.523 90 90 90 Pnma
atom x y z
Fed .186 .063 .328
Fec .036 .25 .852
C .89 .25 .45
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Cohenite
Fasiska E J, Jeffery G A
Acta Crystallographica 19 (1965) 463-471
On the cementite structure
_database_code_amcsd 0019129
5.0598 6.7462 4.5074 90 90 90 Pnma
atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
FeG .1816 .0666 .3374 .9 .0010 .0027 .0048 0 .0009 .0002
MnG .1816 .0666 .3374 .1 .0010 .0027 .0048 0 .0009 .0002
FeS .0367 .25 .8402 .9 .0027 .0026 .0054 0 .0001 0
MnS .0367 .25 .8402 .1 .0027 .0026 .0054 0 .0001 0
C .877 .25 .444 .035 .005 .022 0 .004 0
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Cohenite
Hendricks B S
Zeitschrift fur Kristallographie 74 (1930) 534-545
The crystal structure of cementite
Note: position of C was incorrectly guessed in this paper
Locality: synthetic
_database_code_amcsd 0010504
4.518 5.069 6.736 90 90 90 Pbnm
atom x y z
Fe1 .34 .17 .065
Fe2 -.16 .05 .25
C 0 0 0
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Cohenite
Meinhardt D, Krisement O
Archiv fur das Eisenhuettenwesen 33 (1962) 493-499
Strukturuntersuchungen an Karbiden des Eisens,
Wolframs und Chroms mit thermischen Neutronen
Locality: synthetic
_database_code_amcsd 0019094
4.514 5.078 6.729 90 90 90 Pbnm
atom x y z
Fe1 .337 .181 .063
Fe2 -.163 .044 .25
C .431 -.119 .25
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Cohenite
Westgren A
Jernkontorets Annaler 1932 (1932) 457-468
Cementitens kristallstruktur
_cod_database_code 1010961
_database_code_amcsd 0017888
4.517 5.07 6.73 90 90 90 Pbnm
atom x y z
Fe1 .333 .175 .065
Fe2 -.167 .04 .25
C1 .43 -.13 .25
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 4.2 K
Locality: synthetic
_database_code_amcsd 0019098
5.082 6.733 4.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1841 .0571 .3329 .014
Fe2 .0336 .25 .8409 .014
C .8942 .25 .4503 .041
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 20 K
Locality: synthetic
_database_code_amcsd 0019099
5.082 6.733 6.513 90 90 90 Pnma
atom x y z Uiso
Fe1 .1844 .0565 .3321 .013
Fe2 .0332 .25 .8410 .013
C .8937 .25 .4494 .038
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 40 K
Locality: synthetic
_database_code_amcsd 0019100
5.082 6.734 6.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1838 .0567 .3326 .017
Fe2 .0330 .25 .8407 .017
C .8941 .25 .4500 .041
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 60 K
Locality: synthetic
_database_code_amcsd 0019101
5.082 6.735 6.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1836 .0571 .3322 .014
Fe2 .0335 .25 .8401 .014
C .8944 .25 .4487 .040
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 80 K
Locality: synthetic
_database_code_amcsd 0019102
5.082 6.735 6.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1842 .0567 .3322 .013
Fe2 .0336 .25 .8410 .013
C .8924 .25 .4490 .038
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 100 K
Locality: synthetic
_database_code_amcsd 0019103
5.082 6.736 6.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1835 .0579 .3337 .013
Fe2 .0339 .25 .8381 .013
C .8950 .25 .4485 .036
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 120 K
Locality: synthetic
_database_code_amcsd 0019104
5.082 6.738 6.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1837 .0575 .3330 .014
Fe2 .0342 .25 .8386 .014
C .8947 .25 .4484 .038
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 140 K
Locality: synthetic
_database_code_amcsd 0019105
5.082 6.740 4.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1843 .0577 .3328 .013
Fe2 .0342 .25 .8403 .013
C .8954 .25 .4495 .038
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 160 K
Locality: synthetic
_database_code_amcsd 0019106
5.082 6.742 4.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1840 .0581 .3332 .014
Fe2 .0344 .25 .8393 .014
C .8961 .25 .4479 .039
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 180 K
Locality: synthetic
_database_code_amcsd 0019107
5.082 6.743 4.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1840 .0576 .3325 .014
Fe2 .0343 .25 .8394 .014
C .8963 .25 .4496 .039
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 200 K
Locality: synthetic
_database_code_amcsd 0019108
5.082 6.746 4.512 90 90 90 Pnma
atom x y z Uiso
Fe1 .1844 .0574 .3319 .015
Fe2 .0344 .25 .8390 .015
C .8957 .25 .4488 .038
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 220 K
Locality: synthetic
_database_code_amcsd 0019109
5.082 6.747 4.513 90 90 90 Pnma
atom x y z Uiso
Fe1 .1842 .0579 .3323 .016
Fe2 .0341 .25 .8405 .016
C .8949 .25 .4493 .038
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 240 K
Locality: synthetic
_database_code_amcsd 0019110
5.082 6.748 4.513 90 90 90 Pnma
atom x y z Uiso
Fe1 .1843 .0584 .3322 .017
Fe2 .0343 .25 .8388 .017
C .8959 .25 .4494 .034
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 260 K
Locality: synthetic
_database_code_amcsd 0019111
5.082 6.750 4.514 90 90 90 Pnma
atom x y z Uiso
Fe1 .1844 .0585 .3325 .014
Fe2 .0348 .25 .8388 .014
C .8982 .25 .4491 .032
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 280 K
Locality: synthetic
_database_code_amcsd 0019112
5.082 6.753 4.514 90 90 90 Pnma
atom x y z Uiso
Fe1 .1843 .0589 .3336 .015
Fe2 .0349 .25 .8378 .015
C .8979 .25 .4474 .033
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 300 K
Locality: synthetic
_database_code_amcsd 0019113
5.081 6.754 4.515 90 90 90 Pnma
atom x y z Uiso
Fe1 .1846 .0594 .3340 .012
Fe2 .0346 .25 .8377 .012
C .8984 .25 .4467 .029
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 320 K
Locality: synthetic
_database_code_amcsd 0019114
5.081 6.755 4.515 90 90 90 Pnma
atom x y z Uiso
Fe1 .1845 .0584 .3330 .014
Fe2 .0347 .25 .8373 .014
C .8974 .25 .4502 .028
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 340 K
Locality: synthetic
_database_code_amcsd 0019115
5.081 6.756 4.517 90 90 90 Pnma
atom x y z Uiso
Fe1 .1844 .0592 .3343 .016
Fe2 .0345 .25 .8362 .016
C .8982 .25 .4488 .028
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 360 K
Locality: synthetic
_database_code_amcsd 0019116
5.080 6.757 4.518 90 90 90 Pnma
atom x y z Uiso
Fe1 .1855 .0593 .3331 .014
Fe2 .0353 .25 .8368 .014
C .9008 .25 .4483 .023
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 380 K
Locality: synthetic
_database_code_amcsd 0019117
5.080 6.759 4.518 90 90 90 Pnma
atom x y z Uiso
Fe1 .1845 .0592 .3347 .018
Fe2 .0350 .25 .8355 .018
C .8997 .25 .4495 .026
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 400 K
Locality: synthetic
_database_code_amcsd 0019118
5.080 6.760 4.518 90 90 90 Pnma
atom x y z Uiso
Fe1 .1863 .0587 .3323 .016
Fe2 .0353 .25 .8378 .016
C .8987 .25 .4504 .024
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 420 K
Locality: synthetic
_database_code_amcsd 0019119
5.079 6.761 4.518 90 90 90 Pnma
atom x y z Uiso
Fe1 .1862 .0593 .3328 .015
Fe2 .0352 .25 .8357 .015
C .9016 .25 .4482 .021
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 440 K
Locality: synthetic
_database_code_amcsd 0019120
5.078 6.763 4.518 90 90 90 Pnma
atom x y z Uiso
Fe1 .1858 .0593 .3341 .016
Fe2 .0356 .25 .8338 .016
C .9015 .25 .4495 .018
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 460 K
Locality: synthetic
_database_code_amcsd 0019121
5.077 6.764 4.518 90 90 90 Pnma
atom x y z Uiso
Fe1 .1865 .0595 .3344 .016
Fe2 .0349 .25 .8344 .016
C .9011 .25 .4488 .015
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 480 K
Locality: synthetic
_database_code_amcsd 0019122
5.078 6.766 4.519 90 90 90 Pnma
atom x y z Uiso
Fe1 .1874 .0590 .3323 .015
Fe2 .0348 .25 .8361 .015
C .9024 .25 .4490 .017
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 500 K
Locality: synthetic
_database_code_amcsd 0019123
5.077 6.767 4.520 90 90 90 Pnma
atom x y z Uiso
Fe1 .1886 .0589 .3321 .016
Fe2 .0354 .25 .8373 .016
C .9021 .25 .4491 .015
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 520 K
Locality: synthetic
_database_code_amcsd 0019124
5.080 6.770 4.522 90 90 90 Pnma
atom x y z Uiso
Fe1 .1884 .0588 .3330 .016
Fe2 .0348 .25 .8350 .016
C .9036 .25 .4485 .013
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 540 K
Locality: synthetic
_database_code_amcsd 0019125
5.082 6.772 4.522 90 90 90 Pnma
atom x y z Uiso
Fe1 .1883 .0579 .3320 .020
Fe2 .0340 .25 .8355 .020
C .9045 .25 .4491 .018
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 560 K
Locality: synthetic
_database_code_amcsd 0019126
5.083 6.775 4.523 90 90 90 Pnma
atom x y z Uiso
Fe1 .1895 .0585 .3319 .019
Fe2 .0342 .25 .8352 .019
C .9045 .25 .4480 .014
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 580 K
Locality: synthetic
_database_code_amcsd 0019127
5.085 6.776 4.524 90 90 90 Pnma
atom x y z Uiso
Fe1 .1902 .0573 .3307 .022
Fe2 .0342 .25 .8388 .022
C .9049 .25 .4490 .019
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Cohenite
Wood I G, Vocadlo L, Knight K S, Dobson D P, Marshall W G, Price G D, Brodholt J
Journal of Applied Crystallography 37 (2004) 82-90
Thermal expansion and crystal structure of cementite, Fe3C, between 4 and 600 K
determined by time-of-flight neutron powder diffraction
Note: T = 600 K
Locality: synthetic
_database_code_amcsd 0019128
5.087 6.779 4.526 90 90 90 Pnma
atom x y z Uiso
Fe1 .1905 .0572 .3314 .023
Fe2 .0345 .25 .8371 .023
C .9060 .25 .4481 .016
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Cohenite
Fruchart D, Chaudouet P, Fruchart R, Rouault A, Senateur J P
Journal of Solid State Chemistry 51 (1984) 246-252
Etudes structurales de composes de type cementite: effet de l'hydrogene sur
Fe3C suivi par diffraction neutronique. Spectrometrie Mossbauer sur FeCo2B et
Co3B dopes au 57Fe
Locality: synthetic
_database_code_amcsd 0013522
5.092 6.741 4.527 90 90 90 Pnma
atom x y z Biso
Fe1 .1834 .0689 .3344 .43
Fe2 .0388 .25 .8422 1.0
C .8764 .25 .4426 .9
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Cohenite
Shimura S
Proceedings of the Japan Academy 6 (1930) 269-271
A study on the structure of cementite
Locality: synthetic
_cod_database_code 1010931
_database_code_amcsd 0017653
4.511 5.046 6.738 90 90 90 Pbnm
atom x y z
Fe1 .2050 .1987 0
Fe2 .0550 .4325 .3156
C .181 .415 0
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Cohenite
Lyashchenko B G, Sorokin L M
Soviet Physics Crystallography 8 (1963) 300-304
Determination of the position of carbon in cementite by the neutron diffraction method
Locality: synthetic
_database_code_amcsd 0019132
4.525 5.088 6.74 90 90 90 Pbnm
atom x y z
Fe1 .333 .183 .065
Fe2 -.167 .040 .25
C .04 .354 .25
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Cohenite
Lipson H, Petch N J
The Journal of the Iron and Steel Institute (London) 142 (1940) 95-103
The crystal structure of cementite, Fe3C
Locality: synthetic
_database_code_amcsd 0019095
4.5144 5.0787 6.7297 90 90 90 Pbnm
atom x y z
Fe1 .333 .183 .065
Fe2 .167 .040 .25
C .47 .14 .25
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