HoH7(IrRh)2
Alexandria ALEXAlex-ID: agm006458490 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D7_385_spg8
Ir2Rh5 Ir3Rh4 H8Rh3 HoH6Ir
2024-02-29 08:12:48.870339
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006458490).
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 agm006458490
data_agm006458490
_cell_length_a 7.44477
_cell_length_b 7.44477
_cell_length_c 7.44477
_cell_angle_alpha 151.48898
_cell_angle_beta 146.95725
_cell_angle_gamma 44.19354
_cell_volume 107.08829
_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 0.99379 0.00000 0.99379 1.00000
H1 H 0.06397 0.61539 0.44857 1.00000
H2 H 0.31378 0.22559 0.08819 1.00000
H3 H 0.41826 0.90080 0.51746 1.00000
H4 H 0.83318 0.38461 0.44857 1.00000
H5 H 0.86260 0.77441 0.08819 1.00000
H6 H 0.61666 0.09920 0.51746 1.00000
H7 H 0.30011 0.50000 0.80011 1.00000
Ir1 Ir 0.26220 0.74032 0.52189 1.00000
Ir2 Ir 0.78157 0.25968 0.52189 1.00000
Rh1 Rh 0.63103 0.60424 0.02679 1.00000
Rh2 Rh 0.42255 0.39576 0.02679 1.00000
Get direct link