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Li0.66 Mn1.34 N |
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Niewa R, DiSalvo F, Yang D, Zax D, Luo H, Yelon W |
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Journal of Alloys and Compounds 266 (1998) 32-38 |
|
Synthesis, crystal structure and properties of a lithium manganese |
|
nitride, (Li, Mn)2 N |
|
_cod_database_code 1005047 |
|
_database_code_amcsd 0012807 |
|
4.68578 4.68578 2.97762 90 90 90 P4_2/mnm |
|
atom x y z occ |
|
N1 0 0 0 |
|
Mn1 .2989 .2989 0 .67 |
|
Li1 .2989 .2989 0 .33 |
|
|
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|
| |
|
Li0.86 Mn1.14 N |
| |
Niewa R, DiSalvo F, Yang D, Zax D, Luo H, Yelon W |
| |
Journal of Alloys and Compounds 266 (1998) 32-38 |
|
Synthesis, crystal structure and properties of a lithium manganese |
|
nitride, (Li, Mn)2 N |
|
_cod_database_code 1005048 |
|
_database_code_amcsd 0012808 |
|
4.69795 4.69795 2.96053 90 90 90 P4_2/mnm |
|
atom x y z occ |
|
N1 0 0 0 |
|
Mn1 .2971 .2971 0 .571 |
|
Li1 .2971 .2971 0 .429 |
|
|
| Download AMC data (View Text File)
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|
| |
|
B Fe14 Nd2 |
| |
Isnard O, Yelon W, Miraglia S, Fruchart D |
| |
Journal of Applied Physics 78 (1995) 1892-1898 |
|
Neutron-diffraction study of the insertion scheme of hydrogen in Nd2Fe14 B |
|
_cod_database_code 1008718 |
|
_database_code_amcsd 0016602 |
|
8.805 8.805 12.206 90 90 90 P4_2/mnm |
|
atom x y z |
|
Nd1 .1415 .1415 0 |
|
Nd2 .7313 .2687 0 |
|
Fe1 0 .5 0 |
|
Fe2 .7235 .0671 .3731 |
|
Fe3 .4621 .1413 .3237 |
|
Fe4 .1826 .1826 .2535 |
|
Fe5 .4021 .4021 .2951 |
|
Fe6 0 0 .3856 |
|
B1 .3757 .3757 0 |
|
|
| Download AMC data (View Text File)
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|
| |
|
B Fe14 H1.04 Nd2 |
| |
Isnard O, Yelon W, Miraglia S, Fruchart D |
| |
Journal of Applied Physics 78 (1995) 1892-1898 |
|
Neutron-diffraction study of the insertion scheme of hydrogen in Nd2Fe14 B |
|
_cod_database_code 1008719 |
|
_database_code_amcsd 0016603 |
|
8.841 8.841 12.242 90 90 90 P4_2/mnm |
|
atom x y z occ |
|
Nd1 .1434 .1434 0 |
|
Nd2 .7298 .2702 0 |
|
Fe1 0 .5 0 |
|
Fe2 .7250 .0670 .3723 |
|
Fe3 .4630 .1390 .3242 |
|
Fe4 .1827 .1827 .2550 |
|
Fe5 .4015 .4015 .2957 |
|
Fe6 0 0 .3847 |
|
B1 .3759 .3759 0 |
|
H1 .3988 .3988 .5683 .5 |
|
H2 .436 .2899 .5945 .01 |
|
|
| Download AMC data (View Text File)
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|
| |
|
B Fe14 H1.86 Nd2 |
| |
Isnard O, Yelon W, Miraglia S, Fruchart D |
| |
Journal of Applied Physics 78 (1995) 1892-1898 |
|
Neutron-diffraction study of the insertion scheme of hydrogen in Nd2Fe14 B |
|
_cod_database_code 1008720 |
|
_database_code_amcsd 0016604 |
|
8.869 8.869 12.294 90 90 90 P4_2/mnm |
|
atom x y z occ |
|
Nd1 .1438 .1438 0 |
|
Nd2 .7271 .2729 0 |
|
Fe1 0 .5 0 |
|
Fe2 .7244 .0665 .3717 |
|
Fe3 .4635 .1386 .3245 |
|
Fe4 .1825 .1825 .2546 |
|
Fe5 .4012 .4012 .2939 |
|
Fe6 0 0 .3837 |
|
B1 .3762 .3762 0 |
|
H1 .4020 .4020 .5703 .41 |
|
H2 .4329 .3048 .5972 .26 |
|
|
| Download AMC data (View Text File)
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|
| |
|
B Fe14 H3.31 Nd2 |
| |
Isnard O, Yelon W, Miraglia S, Fruchart D |
| |
Journal of Applied Physics 78 (1995) 1892-1898 |
|
Neutron-diffraction study of the insertion scheme of hydrogen in Nd2Fe14 B |
|
_cod_database_code 1008721 |
|
_database_code_amcsd 0016605 |
|
8.906 8.906 12.327 90 90 90 P4_2/mnm |
|
atom x y z occ |
|
Nd1 .1453 .1453 0 |
|
Nd2 .7252 .2748 0 |
|
Fe1 0 .5 0 |
|
Fe2 .7254 .0676 .3712 |
|
Fe3 .4632 .1380 .3236 |
|
Fe4 .1816 .1816 .2548 |
|
Fe5 .4003 .4003 .2938 |
|
Fe6 0 0 .3841 |
|
B1 .3767 .3767 0 |
|
H1 .3996 .3996 .5733 .39 |
|
H2 .4380 .2970 .5982 .38 |
|
H3 .4706 .179 .5369 .23 |
|
H4 .5 .5 .6153 .09 |
|
|
| Download AMC data (View Text File)
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|
| |
|
B Fe14 H4.73 Nd2 |
| |
Isnard O, Yelon W, Miraglia S, Fruchart D |
| |
Journal of Applied Physics 78 (1995) 1892-1898 |
|
Neutron-diffraction study of the insertion scheme of hydrogen in Nd2Fe14 B |
|
_cod_database_code 1008722 |
|
_database_code_amcsd 0016606 |
|
8.917 8.917 12.344 90 90 90 P4_2/mnm |
|
atom x y z occ |
|
Nd1 .1471 .1471 0 |
|
Nd2 .7221 .2779 0 |
|
Fe1 0 .5 0 |
|
Fe2 .7269 .0669 .3709 |
|
Fe3 .4644 .1374 .3224 |
|
Fe4 .1830 .1830 .2548 |
|
Fe5 .4005 .4005 .2940 |
|
Fe6 0 0 .3833 |
|
B1 .3758 .3758 0 |
|
H1 .4017 .4017 .5758 .24 |
|
H2 .4372 .2890 .5947 .48 |
|
H3 .4717 .1799 .5383 .49 |
|
H4 .5 .5 .6119 .37 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Lawrencite |
 |
Vettier C, Yelon W B |
| |
Journal of Physics and Chemistry of Solids 36 (1975) 401-405 |
|
The structure of FeCl2 at high pressures |
|
Note: P = 1.04 kbar |
|
_database_code_amcsd 0018598 |
|
3.598 3.598 17.481 90 90 120 R-3m |
|
atom x y z Biso |
|
Fe 0 0 0 1.1 |
|
Cl 1/3 2/3 .2550 1.4 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Lawrencite |
|
Vettier C, Yelon W B |
| |
Journal of Physics and Chemistry of Solids 36 (1975) 401-405 |
|
The structure of FeCl2 at high pressures |
|
Note: P = 3.15 kbar |
|
_database_code_amcsd 0018599 |
|
3.592 3.592 17.384 90 90 120 R-3m |
|
atom x y z Biso |
|
Fe 0 0 0 1.2 |
|
Cl 1/3 2/3 .2546 1.2 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Lawrencite |
|
Vettier C, Yelon W B |
| |
Journal of Physics and Chemistry of Solids 36 (1975) 401-405 |
|
The structure of FeCl2 at high pressures |
|
Note: P = 5.70 kbar |
|
_database_code_amcsd 0018600 |
|
3.589 3.589 17.260 90 90 120 R-3m |
|
atom x y z Biso |
|
Fe 0 0 0 1.2 |
|
Cl 1/3 2/3 .2534 1.3 |
|
|
| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Lawrencite |
|
Vettier C, Yelon W B |
| |
Journal of Physics and Chemistry of Solids 36 (1975) 401-405 |
|
The structure of FeCl2 at high pressures |
|
Note: P = 5.97 kbar |
|
_database_code_amcsd 0018601 |
|
3.585 3.585 5.735 90 90 120 P-3m1 |
|
atom x y z Biso |
|
Fe 0 0 0 1.3 |
|
Cl 1/3 2/3 .2390 1.1 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Lawrencite |
|
Vettier C, Yelon W B |
| |
Journal of Physics and Chemistry of Solids 36 (1975) 401-405 |
|
The structure of FeCl2 at high pressures |
|
Note: P = 6.40 kbar |
|
_database_code_amcsd 0018602 |
|
3.585 3.585 5.735 90 90 120 P-3m1 |
|
atom x y z Biso |
|
Fe 0 0 0 1.4 |
|
Cl 1/3 2/3 .2393 1.4 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Fe12.91 Nd2 Si4.09 |
| |
Long G, Marasinghe G, Mishra S, Pringle O, Grandjean F, Buschow K, |
|
Middleton D, Yelon W, Pourarian F, Isnard O |
| |
Solid State Communications 88 (1993) 761-764 |
|
A neutron diffraction and Mossbauer effect study of the Nd2Fe17-xSix |
|
solid solutions |
|
_cod_database_code 1008641 |
|
_database_code_amcsd 0016530 |
|
8.5325 8.5325 12.4554 90 90 120 R-3m |
|
atom x y z occ |
|
Nd1 0 0 .3419 |
|
Fe1 0 0 .0961 |
|
Fe2 .5 0 .5 .848 |
|
Fe3 .2918 0 0 .792 |
|
Fe4 .5015 .4985 .1579 .602 |
|
Si1 .5 0 .5 .152 |
|
Si2 .2918 0 0 .208 |
|
Si3 .5015 .4985 .1579 .398 |
|
|
| Download AMC data (View Text File)
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View JMOL 3-D Structure
|
| |
|
Ce2 Mn N3 |
| |
Niewa R, Vajenine G, DiSalvo F, Haihua L, Yelon W |
| |
Zeitschrift fur Naturforschung, Teil B. Anorganische Chemie, 53 (1998) 63-74 |
|
Unusual Bonding in ternary nitrides: Preparation, structure and |
|
properties of Ce2 Mn N3 |
|
_cod_database_code 1005058 |
|
_database_code_amcsd 0015850 |
|
3.74994 3.44450 12.4601 90 90 90 Immm |
|
atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Ce1 0 0 .35332 .0191 .0256 .0269 0 0 0 |
|
Mn1 0 0 0 .022 .027 .034 0 0 0 |
|
N1 0 .5 .5 .023 .028 .013 0 0 0 |
|
N2 0 0 .1638 .013 .016 .028 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
|
| |
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