Al6Ir5Os
Alexandria ALEXAlex-ID: agm065734151 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_53_spg71
Al6Ir5Os
2024-11-14 01:11:55.600193
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm065734151).
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 agm065734151
data_agm065734151
_cell_length_a 7.37101
_cell_length_b 7.37101
_cell_length_c 7.37101
_cell_angle_alpha 146.38172
_cell_angle_beta 131.65839
_cell_angle_gamma 60.16971
_cell_volume 164.12884
_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
Al1 Al 0.08667 0.83481 0.25185 1.00000
Al2 Al 0.58296 0.83481 0.74815 1.00000
Al3 Al 0.25381 0.50000 0.75381 1.00000
Al4 Al 0.74619 0.50000 0.24619 1.00000
Al5 Al 0.41704 0.16519 0.25185 1.00000
Al6 Al 0.91333 0.16519 0.74815 1.00000
Ir1 Ir 0.66893 0.66893 0.00000 1.00000
Ir2 Ir 0.83341 0.33341 0.50000 1.00000
Ir3 Ir 0.00000 0.00000 0.00000 1.00000
Ir4 Ir 0.16659 0.66659 0.50000 1.00000
Ir5 Ir 0.33107 0.33107 0.00000 1.00000
Os1 Os 0.50000 0.00000 0.50000 1.00000
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