Os2RhBr2
Alexandria ALEXAlex-ID: agm005406915 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_5_spg139
OsRh8 RhBr3 Os
2023-03-17 10:52:11.367177
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005406915).
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 agm005406915
data_agm005406915
_cell_length_a 6.46822
_cell_length_b 6.46822
_cell_length_c 6.46822
_cell_angle_alpha 143.62040
_cell_angle_beta 143.62040
_cell_angle_gamma 52.39531
_cell_volume 94.64779
_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
Os1 Os 0.59795 0.59795 0.00000 1.00000
Os2 Os 0.40205 0.40205 0.00000 1.00000
Rh1 Rh 0.00000 0.00000 0.00000 1.00000
Br1 Br 0.25000 0.75000 0.50000 1.00000
Br2 Br 0.75000 0.25000 0.50000 1.00000
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