HoZnGa3Cu
Alexandria ALEXAlex-ID: agm005044827 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD3_383_spg63
Ho(ZnGa)2 HoGa3 Ho(GaCu)6
2022-07-05 18:41:48.555005
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005044827).
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 agm005044827
data_agm005044827
_cell_length_a 5.73800
_cell_length_b 5.52242
_cell_length_c 7.52665
_cell_angle_alpha 111.52195
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 221.87254
_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 0.31122 0.62245 1.00000
Ho2 Ho 0.25000 0.68878 0.37755 1.00000
Zn1 Zn 0.25000 0.34375 0.68750 1.00000
Zn2 Zn 0.75000 0.65625 0.31250 1.00000
Ga1 Ga 0.25000 0.13820 0.27639 1.00000
Ga2 Ga 0.00000 0.26863 1.00000 1.00000
Ga3 Ga 0.50000 0.73137 0.00000 1.00000
Ga4 Ga 0.50000 0.26863 1.00000 1.00000
Ga5 Ga 0.00000 0.73137 0.00000 1.00000
Ga6 Ga 0.75000 0.86180 0.72361 1.00000
Cu1 Cu 0.25000 0.88957 0.77914 1.00000
Cu2 Cu 0.75000 0.11043 0.22086 1.00000
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