Y3HoIr4
Alexandria ALEXAlex-ID: agm015900074 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4_344_spg139
Y2HoIr3 Y4Ir3 YIr2
2024-11-13 22:46:02.679647
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm015900074).
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 agm015900074
data_agm015900074
_cell_length_a 7.58391
_cell_length_b 7.58391
_cell_length_c 7.58391
_cell_angle_alpha 142.37942
_cell_angle_beta 142.37942
_cell_angle_gamma 54.25768
_cell_volume 161.43878
_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
Y1 Y 0.00000 0.00000 0.00000 1.00000
Y2 Y 0.74979 0.74979 0.00000 1.00000
Y3 Y 0.25021 0.25021 0.00000 1.00000
Ho1 Ho 0.50000 0.50000 0.00000 1.00000
Ir1 Ir 0.37587 0.87587 0.50000 1.00000
Ir2 Ir 0.62413 0.12413 0.50000 1.00000
Ir3 Ir 0.12413 0.62413 0.50000 1.00000
Ir4 Ir 0.87587 0.37587 0.50000 1.00000
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