Ho2URu3
Alexandria ALEXAlex-ID: agm005682073 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_906_spg65
Ho2URu3
2023-08-24 17:02:25.451643
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005682073).
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 agm005682073
data_agm005682073
_cell_length_a 4.89440
_cell_length_b 7.50011
_cell_length_c 6.83901
_cell_angle_alpha 88.36536
_cell_angle_beta 84.98463
_cell_angle_gamma 70.95632
_cell_volume 236.40117
_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 0.00000 0.00000 0.00000 1.00000
Ho2 Ho 0.00000 0.00000 0.50000 1.00000
Ho3 Ho 0.33599 0.32802 0.50000 1.00000
Ho4 Ho 0.66401 0.67198 0.50000 1.00000
U1 U 0.33491 0.33018 0.00000 1.00000
U2 U 0.66509 0.66982 1.00000 1.00000
Ru1 Ru 0.77880 0.35036 0.77876 1.00000
Ru2 Ru 0.48984 1.00000 0.22787 1.00000
Ru3 Ru 0.22120 0.64964 0.22124 1.00000
Ru4 Ru 0.87084 0.35036 0.22125 1.00000
Ru5 Ru 0.12916 0.64964 0.77875 1.00000
Ru6 Ru 0.51016 0.00000 0.77213 1.00000
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