YRe5
Alexandria ALEXAlex-ID: agm005469740 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5_525_spg8
YRe2 Re
2023-03-22 22:58:33.851738
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005469740).
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 agm005469740
data_agm005469740
_cell_length_a 5.46476
_cell_length_b 5.46476
_cell_length_c 6.88028
_cell_angle_alpha 73.55196
_cell_angle_beta 73.55196
_cell_angle_gamma 30.78965
_cell_volume 100.53936
_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
Y1 Y 0.29982 0.29982 0.92445 1.00000
Re1 Re 0.01976 0.01976 0.02223 1.00000
Re2 Re 0.60562 0.60562 0.28790 1.00000
Re3 Re 0.32086 0.32086 0.35981 1.00000
Re4 Re 0.94884 0.94884 0.57330 1.00000
Re5 Re 0.63844 0.63844 0.66565 1.00000
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