Pm2V2N5
Alexandria ALEXAlex-ID: agm005565484 · Space group: Ima2 (#46)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_129_spg46
Pm3(VN3)2 VN N2
2023-06-03 03:32:51.430111
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005565484).
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 agm005565484
data_agm005565484
_cell_length_a 5.67208
_cell_length_b 5.42016
_cell_length_c 8.57750
_cell_angle_alpha 108.41830
_cell_angle_beta 109.30747
_cell_angle_gamma 90.00000
_cell_volume 234.51084
_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
Pm1 Pm 0.12883 0.59665 0.21611 1.00000
Pm2 Pm 0.87117 0.38054 0.78389 1.00000
Pm3 Pm 0.58728 0.09665 0.21611 1.00000
Pm4 Pm 0.41272 0.88054 0.78389 1.00000
V1 V 0.00000 0.98578 0.00000 1.00000
V2 V 0.50000 0.48578 0.00000 1.00000
V3 V 0.17196 0.28937 0.50000 1.00000
V4 V 0.82804 0.78937 0.50000 1.00000
N1 N 0.24290 0.73542 0.98301 1.00000
N2 N 0.75710 0.75241 0.01699 1.00000
N3 N 0.24011 0.23542 0.98301 1.00000
N4 N 0.75989 0.25241 0.01699 1.00000
N5 N 0.20242 0.12926 0.29009 1.00000
N6 N 0.79758 0.83917 0.70991 1.00000
N7 N 0.58767 0.62926 0.29009 1.00000
N8 N 0.41233 0.33917 0.70991 1.00000
N9 N 0.11531 0.62741 0.50000 1.00000
N10 N 0.88469 0.12741 0.50000 1.00000
Get direct link