Re5Si3
Alexandria ALEXAlex-ID: agm005284131 · Space group: I4/mcm (#140)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B5_0_spg140
Re2Si Re4Si7
2023-05-07 10:46:09.988521
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005284131).
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 agm005284131
data_agm005284131
_cell_length_a 7.12613
_cell_length_b 7.12613
_cell_length_c 7.12613
_cell_angle_alpha 96.94234
_cell_angle_beta 96.94234
_cell_angle_gamma 139.31096
_cell_volume 221.20979
_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
Re1 Re 0.72335 0.42772 0.15107 1.00000
Re2 Re 0.27665 0.57228 0.84893 1.00000
Re3 Re 0.77665 0.92772 0.70437 1.00000
Re4 Re 0.22335 0.07228 0.29563 1.00000
Re5 Re 0.57228 0.72335 0.29563 1.00000
Re6 Re 0.42772 0.27665 0.70437 1.00000
Re7 Re 0.07228 0.77665 0.84893 1.00000
Re8 Re 0.92772 0.22335 0.15107 1.00000
Re9 Re 0.25000 0.75000 0.50000 1.00000
Re10 Re 0.75000 0.25000 0.50000 1.00000
Si1 Si 0.17164 0.32836 0.50000 1.00000
Si2 Si 0.82836 0.67164 0.50000 1.00000
Si3 Si 0.32836 0.82836 0.15672 1.00000
Si4 Si 0.67164 0.17164 0.84328 1.00000
Si5 Si 0.75000 0.75000 0.00000 1.00000
Si6 Si 0.25000 0.25000 0.00000 1.00000
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