Ho3(ScSi2)2
Alexandria ALEXAlex-ID: agm035756983 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_216_spg64
Ho2ScSi2 Ho2Sc3Si4 HoSi
2024-12-20 13:27:54
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm035756983).
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 agm035756983
data_agm035756983
_cell_length_a 7.17770
_cell_length_b 7.48139
_cell_length_c 7.44369
_cell_angle_alpha 90.00000
_cell_angle_beta 108.46929
_cell_angle_gamma 90.00000
_cell_volume 379.13197
_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 0.50000 0.50000 0.50000 1.00000
Ho2 Ho 0.00000 0.00000 0.50000 1.00000
Ho3 Ho 0.42582 0.82381 0.80724 1.00000
Ho4 Ho 0.07418 0.32381 0.19276 1.00000
Ho5 Ho 0.57418 0.17619 0.19276 1.00000
Ho6 Ho 0.92582 0.67619 0.80724 1.00000
Sc1 Sc 0.25250 0.31952 0.75374 1.00000
Sc2 Sc 0.24750 0.81952 0.24626 1.00000
Sc3 Sc 0.74750 0.68048 0.24626 1.00000
Sc4 Sc 0.75250 0.18048 0.75374 1.00000
Si1 Si 0.63693 0.46444 0.92615 1.00000
Si2 Si 0.86307 0.96444 0.07385 1.00000
Si3 Si 0.36307 0.53556 0.07385 1.00000
Si4 Si 0.13693 0.03556 0.92615 1.00000
Si5 Si 0.37830 0.12035 0.49282 1.00000
Si6 Si 0.12170 0.62035 0.50718 1.00000
Si7 Si 0.62170 0.87965 0.50718 1.00000
Si8 Si 0.87830 0.37965 0.49282 1.00000
Get direct link