Al3Rh2
Alexandria ALEXAlex-ID: agm005507301 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3_78_spg2
Al5Rh2 AlRh
2023-03-19 16:32:56.989650
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005507301).
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 agm005507301
data_agm005507301
_cell_length_a 4.88896
_cell_length_b 5.72477
_cell_length_c 5.79970
_cell_angle_alpha 103.21239
_cell_angle_beta 107.69475
_cell_angle_gamma 96.50615
_cell_volume 147.59730
_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 0.72275 0.85828 0.63928 1.00000
Al2 Al 0.88386 0.35986 0.61371 1.00000
Al3 Al 0.11614 0.64014 0.38629 1.00000
Al4 Al 0.27725 0.14172 0.36072 1.00000
Al5 Al 0.67643 0.88096 0.13989 1.00000
Al6 Al 0.32357 0.11904 0.86011 1.00000
Rh1 Rh 0.54545 0.49761 0.25869 1.00000
Rh2 Rh 0.89326 0.23224 0.00618 1.00000
Rh3 Rh 0.10674 0.76776 0.99382 1.00000
Rh4 Rh 0.45455 0.50239 0.74131 1.00000
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