Sr3Os3N5
Alexandria ALEXAlex-ID: agm005259781 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C5_2_spg2
Sr8Os3N8 Sr2OsN4 Os
2023-05-09 03:15:53.181194
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005259781).
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 agm005259781
data_agm005259781
_cell_length_a 5.93673
_cell_length_b 7.19276
_cell_length_c 9.55676
_cell_angle_alpha 110.64500
_cell_angle_beta 105.04516
_cell_angle_gamma 92.22639
_cell_volume 364.93361
_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
Sr1 Sr 0.82210 0.42141 0.61629 1.00000
Sr2 Sr 0.17790 0.57859 0.38371 1.00000
Sr3 Sr 0.66098 0.86557 0.89380 1.00000
Sr4 Sr 0.33902 0.13443 0.10620 1.00000
Sr5 Sr 0.66141 0.69232 0.21263 1.00000
Sr6 Sr 0.33859 0.30768 0.78737 1.00000
Os1 Os 0.88368 0.32466 0.97030 1.00000
Os2 Os 0.11632 0.67534 0.02970 1.00000
Os3 Os 0.64615 0.91536 0.58926 1.00000
Os4 Os 0.35385 0.08464 0.41074 1.00000
Os5 Os 0.09304 0.87211 0.70872 1.00000
Os6 Os 0.90696 0.12789 0.29128 1.00000
N1 N 0.89761 0.10571 0.78308 1.00000
N2 N 0.10239 0.89429 0.21692 1.00000
N3 N 0.82159 0.70396 0.50079 1.00000
N4 N 0.17841 0.29604 0.49921 1.00000
N5 N 0.73146 0.54113 0.92669 1.00000
N6 N 0.26854 0.45887 0.07331 1.00000
N7 N 0.35946 0.90347 0.64490 1.00000
N8 N 0.64054 0.09653 0.35510 1.00000
N9 N 0.12483 0.75691 0.86407 1.00000
N10 N 0.87517 0.24309 0.13593 1.00000
