Ho2Si5Ni2Ru
Alexandria ALEXAlex-ID: agm039092452 · Space group: Ibam (#72)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D5_56_spg15
Ho2Si5Ni2Ru
2024-11-01 07:29:28.722108
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm039092452).
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 agm039092452
data_agm039092452
_cell_length_a 7.91667
_cell_length_b 7.91667
_cell_length_c 7.91667
_cell_angle_alpha 137.63121
_cell_angle_beta 104.92111
_cell_angle_gamma 90.21135
_cell_volume 308.43208
_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
Ho1 Ho 0.39731 0.13110 0.26621 1.00000
Ho2 Ho 0.86489 0.63110 0.23379 1.00000
Ho3 Ho 0.60269 0.86890 0.73379 1.00000
Ho4 Ho 0.13511 0.36890 0.76621 1.00000
Si1 Si 0.73548 0.39400 0.34147 1.00000
Si2 Si 0.05253 0.89400 0.15853 1.00000
Si3 Si 0.26452 0.60600 0.65853 1.00000
Si4 Si 0.94747 0.10600 0.84147 1.00000
Si5 Si 0.50000 0.25000 0.75000 1.00000
Si6 Si 0.50000 0.75000 0.25000 1.00000
Si7 Si 0.23141 0.98141 0.75000 1.00000
Si8 Si 0.76859 0.01859 0.25000 1.00000
Si9 Si 0.76859 0.51859 0.75000 1.00000
Si10 Si 0.23141 0.48141 0.25000 1.00000
Ni1 Ni 0.47308 0.36356 0.10952 1.00000
Ni2 Ni 0.25405 0.86356 0.39048 1.00000
Ni3 Ni 0.52692 0.63644 0.89048 1.00000
Ni4 Ni 0.74595 0.13644 0.60952 1.00000
Ru1 Ru 0.00000 0.75000 0.75000 1.00000
Ru2 Ru 0.00000 0.25000 0.25000 1.00000
