Os5Au3
Alexandria ALEXAlex-ID: agm007935807 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B5_28_spg42
Au Os
2024-06-24 11:50:25.450971
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007935807).
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 agm007935807
data_agm007935807
_cell_length_a 7.24497
_cell_length_b 7.24497
_cell_length_c 5.34694
_cell_angle_alpha 70.63850
_cell_angle_beta 70.63850
_cell_angle_gamma 84.16511
_cell_volume 249.80092
_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 0.91064 0.34358 0.02556 1.00000
Os2 Os 0.30031 0.21509 0.71515 1.00000
Os3 Os 0.54650 0.45350 0.25000 1.00000
Os4 Os 0.78491 0.69969 0.78485 1.00000
Os5 Os 0.65642 0.08936 0.47444 1.00000
Os6 Os 0.34358 0.91064 0.52556 1.00000
Os7 Os 0.21509 0.30031 0.21515 1.00000
Os8 Os 0.45350 0.54650 0.75000 1.00000
Os9 Os 0.69969 0.78491 0.28485 1.00000
Os10 Os 0.08936 0.65642 0.97444 1.00000
Au1 Au 0.41977 0.83462 0.00649 1.00000
Au2 Au 0.03857 0.96143 0.25000 1.00000
Au3 Au 0.16538 0.58023 0.49351 1.00000
Au4 Au 0.83462 0.41977 0.50649 1.00000
Au5 Au 0.96143 0.03857 0.75000 1.00000
Au6 Au 0.58023 0.16538 0.99351 1.00000
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