LiCoWN3
Alexandria ALEXAlex-ID: agm005037101 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD3_492_spg11
CoN LiN3 W2N3 Li6WN4
2022-07-06 00:29:58.604139
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005037101).
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 agm005037101
data_agm005037101
_cell_length_a 3.00677
_cell_length_b 5.96291
_cell_length_c 8.63228
_cell_angle_alpha 111.14481
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 144.34883
_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
Li1 Li 0.25000 0.18949 0.13543 1.00000
Li2 Li 0.75000 0.81051 0.86457 1.00000
Co1 Co 0.25000 0.03273 0.61215 1.00000
Co2 Co 0.75000 0.96727 0.38785 1.00000
W1 W 0.25000 0.69561 0.14757 1.00000
W2 W 0.75000 0.30439 0.85243 1.00000
N1 N 0.75000 0.93306 0.15397 1.00000
N2 N 0.25000 0.06694 0.84603 1.00000
N3 N 0.25000 0.78679 0.40441 1.00000
N4 N 0.75000 0.21321 0.59559 1.00000
N5 N 0.75000 0.43905 0.11237 1.00000
N6 N 0.25000 0.56095 0.88763 1.00000
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