Ho4Zn3Ir
Alexandria ALEXAlex-ID: agm017133486 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4_344_spg139
Ho6Zn5Ir Ho5Ir3 HoZn2
2025-01-01 12:15:01
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017133486).
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
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# CIF generated by HEAS from Alexandria entry agm017133486
data_agm017133486
_cell_length_a 7.87496
_cell_length_b 7.87496
_cell_length_c 7.87496
_cell_angle_alpha 143.38417
_cell_angle_beta 143.38417
_cell_angle_gamma 52.74917
_cell_volume 172.69138
_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 0.37943 0.87943 0.50000 1.00000
Ho2 Ho 0.62057 0.12057 0.50000 1.00000
Ho3 Ho 0.12057 0.62057 0.50000 1.00000
Ho4 Ho 0.87943 0.37943 0.50000 1.00000
Zn1 Zn 0.50000 0.50000 0.00000 1.00000
Zn2 Zn 0.25175 0.25175 0.00000 1.00000
Zn3 Zn 0.74825 0.74825 0.00000 1.00000
Ir1 Ir 0.00000 0.00000 0.00000 1.00000
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