U8Rh3
Alexandria ALEXAlex-ID: agm053940887 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B8_327_spg2
URh U
2024-10-02 06:23:28.101522
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm053940887).
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 agm053940887
data_agm053940887
_cell_length_a 5.01711
_cell_length_b 5.35970
_cell_length_c 7.99277
_cell_angle_alpha 93.29106
_cell_angle_beta 81.80128
_cell_angle_gamma 95.77956
_cell_volume 211.44692
_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
U1 U 0.64228 0.54074 0.81795 1.00000
U2 U 0.28433 0.88741 0.36286 1.00000
U3 U 0.20651 0.32740 0.54435 1.00000
U4 U 0.92492 0.74631 0.06033 1.00000
U5 U 0.79349 0.67260 0.45565 1.00000
U6 U 0.71567 0.11259 0.63714 1.00000
U7 U 0.35772 0.45926 0.18205 1.00000
U8 U 0.07508 0.25369 0.93967 1.00000
Rh1 Rh 0.21106 0.78745 0.72144 1.00000
Rh2 Rh 0.78894 0.21255 0.27856 1.00000
Rh3 Rh 0.50000 0.00000 0.00000 1.00000
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