La2Si5RuRh2
Alexandria ALEXAlex-ID: agm040295960 · Space group: Ibam (#72)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D5_56_spg15
La2Si5RuRh2
2024-09-25 04:57:23.041188
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm040295960).
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 agm040295960
data_agm040295960
_cell_length_a 8.33239
_cell_length_b 8.33239
_cell_length_c 8.33239
_cell_angle_alpha 138.43570
_cell_angle_beta 106.50055
_cell_angle_gamma 88.15268
_cell_volume 352.92319
_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
La1 La 0.89821 0.13108 0.76713 1.00000
La2 La 0.36396 0.63108 0.73287 1.00000
La3 La 0.10179 0.86892 0.23287 1.00000
La4 La 0.63604 0.36892 0.26713 1.00000
Si1 Si 0.24667 0.39650 0.85016 1.00000
Si2 Si 0.54634 0.89650 0.64984 1.00000
Si3 Si 0.75333 0.60350 0.14984 1.00000
Si4 Si 0.45366 0.10350 0.35016 1.00000
Si5 Si 0.00000 0.25000 0.25000 1.00000
Si6 Si 0.00000 0.75000 0.75000 1.00000
Si7 Si 0.72178 0.97178 0.25000 1.00000
Si8 Si 0.27822 0.02822 0.75000 1.00000
Si9 Si 0.27822 0.52822 0.25000 1.00000
Si10 Si 0.72178 0.47178 0.75000 1.00000
Ru1 Ru 0.50000 0.75000 0.25000 1.00000
Ru2 Ru 0.50000 0.25000 0.75000 1.00000
Rh1 Rh 0.96838 0.35981 0.60856 1.00000
Rh2 Rh 0.75125 0.85981 0.89144 1.00000
Rh3 Rh 0.03162 0.64019 0.39144 1.00000
Rh4 Rh 0.24875 0.14019 0.10856 1.00000
