Al6ReOs2
Alexandria ALEXAlex-ID: agm017193663 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_1747_spg12
AlRe Al11Re4 Al2Os
2024-12-16 05:46:16
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017193663).
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
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# CIF generated by HEAS from Alexandria entry agm017193663
data_agm017193663
_cell_length_a 7.96884
_cell_length_b 7.15767
_cell_length_c 4.74209
_cell_angle_alpha 81.34357
_cell_angle_beta 62.61997
_cell_angle_gamma 36.03645
_cell_volume 127.98339
_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 0.17230 0.49343 0.50657 1.00000
Al2 Al 0.50657 0.82770 0.17230 1.00000
Al3 Al 0.49343 0.17230 0.82770 1.00000
Al4 Al 0.16138 0.83862 0.16138 1.00000
Al5 Al 0.83862 0.16138 0.83862 1.00000
Al6 Al 0.82770 0.50657 0.49343 1.00000
Re1 Re 0.50000 0.50000 0.50000 1.00000
Os1 Os 0.83205 0.83205 0.16795 1.00000
Os2 Os 0.16795 0.16795 0.83205 1.00000
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