HoReSi3Ni
Alexandria ALEXAlex-ID: agm005043681 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD3_370_spg63
Ho(SiNi)2 Ho2Re3Si5 HoSi2Ni Re4Si7
2022-07-07 07:41:40.114316
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005043681).
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 agm005043681
data_agm005043681
_cell_length_a 5.42784
_cell_length_b 6.13783
_cell_length_c 7.32492
_cell_angle_alpha 114.76955
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 221.58008
_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 0.75000 0.29723 0.59447 1.00000
Ho2 Ho 0.25000 0.70277 0.40553 1.00000
Re1 Re 0.25000 0.05464 0.10928 1.00000
Re2 Re 0.75000 0.94536 0.89072 1.00000
Si1 Si 0.25000 0.22684 0.45367 1.00000
Si2 Si 0.00000 0.30498 1.00000 1.00000
Si3 Si 0.50000 0.69502 0.00000 1.00000
Si4 Si 0.50000 0.30498 1.00000 1.00000
Si5 Si 0.00000 0.69502 0.00000 1.00000
Si6 Si 0.75000 0.77316 0.54633 1.00000
Ni1 Ni 0.25000 0.38977 0.77953 1.00000
Ni2 Ni 0.75000 0.61023 0.22047 1.00000
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