CoWN3
Alexandria ALEXAlex-ID: agm005221409 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_4502_spg2
W2N3 N2 CoN
2023-05-08 06:22:40.622267
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005221409).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm005221409
data_agm005221409
_cell_length_a 5.62254
_cell_length_b 7.45805
_cell_length_c 7.88847
_cell_angle_alpha 64.71598
_cell_angle_beta 69.62690
_cell_angle_gamma 79.06541
_cell_volume 280.06120
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Co1 Co 0.61582 0.83067 0.60109 1.00000
Co2 Co 0.38418 0.16933 0.39891 1.00000
Co3 Co 0.87474 0.18327 0.40496 1.00000
Co4 Co 0.12526 0.81673 0.59504 1.00000
W1 W 0.03772 0.96693 0.17757 1.00000
W2 W 0.96228 0.03307 0.82243 1.00000
W3 W 0.27594 0.57290 0.42306 1.00000
W4 W 0.72406 0.42710 0.57694 1.00000
N1 N 0.69752 0.03484 0.34352 1.00000
N2 N 0.30248 0.96516 0.65648 1.00000
N3 N 0.10130 0.16856 0.93917 1.00000
N4 N 0.89870 0.83144 0.06083 1.00000
N5 N 0.18468 0.04775 0.34105 1.00000
N6 N 0.81532 0.95225 0.65895 1.00000
N7 N 0.07395 0.33440 0.46727 1.00000
N8 N 0.92605 0.66560 0.53273 1.00000
N9 N 0.33811 0.76119 0.17941 1.00000
N10 N 0.66189 0.23881 0.82059 1.00000
N11 N 0.56069 0.35465 0.42839 1.00000
N12 N 0.43931 0.64535 0.57161 1.00000
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