UV2N3
Alexandria ALEXAlex-ID: agm033137103 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_1620_spg63
UVN2 VN
2024-10-22 02:29:37.477071
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm033137103).
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 agm033137103
data_agm033137103
_cell_length_a 7.08448
_cell_length_b 7.08448
_cell_length_c 5.99547
_cell_angle_alpha 89.98670
_cell_angle_beta 89.98670
_cell_angle_gamma 24.86620
_cell_volume 126.53363
_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
U1 U 0.81826 0.81826 0.25009 1.00000
U2 U 0.18174 0.18174 0.74991 1.00000
V1 V 0.50000 0.50000 0.00000 1.00000
V2 V 0.50000 0.50000 0.50000 1.00000
V3 V 0.87414 0.87414 0.75010 1.00000
V4 V 0.12586 0.12586 0.24990 1.00000
N1 N 0.34658 0.34658 0.96879 1.00000
N2 N 0.65341 0.65341 0.46864 1.00000
N3 N 0.65342 0.65342 0.03121 1.00000
N4 N 0.01438 0.01438 0.74999 1.00000
N5 N 0.98562 0.98562 0.25001 1.00000
N6 N 0.34659 0.34659 0.53136 1.00000
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