Y3Si8Rh3
Alexandria ALEXAlex-ID: agm005686107 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C8_19_spg12
Y5(Si7Rh2)2 Y10Si17 Y2Si5Rh3
2023-06-30 23:35:46.477439
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005686107).
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 agm005686107
data_agm005686107
_cell_length_a 4.14808
_cell_length_b 7.71638
_cell_length_c 8.48737
_cell_angle_alpha 64.41641
_cell_angle_beta 75.85553
_cell_angle_gamma 74.40810
_cell_volume 233.42514
_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 0.29765 0.75651 0.64819 1.00000
Y2 Y 0.70235 0.24349 0.35181 1.00000
Y3 Y 0.00000 0.00000 0.00000 1.00000
Si1 Si 0.11169 0.15087 0.62574 1.00000
Si2 Si 0.88831 0.84913 0.37426 1.00000
Si3 Si 0.86351 0.43203 0.84094 1.00000
Si4 Si 0.13649 0.56797 0.15906 1.00000
Si5 Si 0.51745 0.67592 0.28917 1.00000
Si6 Si 0.48255 0.32408 0.71083 1.00000
Si7 Si 0.36385 0.02262 0.24968 1.00000
Si8 Si 0.63615 0.97738 0.75032 1.00000
Rh1 Rh 0.00000 0.50000 0.50000 1.00000
Rh2 Rh 0.67774 0.65730 0.98723 1.00000
Rh3 Rh 0.32226 0.34270 0.01277 1.00000
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