UCu2H8Rh
Alexandria ALEXAlex-ID: agm007406696 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_525_spg2
U2HRh6 U4H15 CuH4 Cu
2024-10-15 11:55:49.060700
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007406696).
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 agm007406696
data_agm007406696
_cell_length_a 3.57995
_cell_length_b 5.00376
_cell_length_c 6.30703
_cell_angle_alpha 95.35888
_cell_angle_beta 108.76251
_cell_angle_gamma 91.44491
_cell_volume 106.32476
_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 0.83373 0.05766 0.36622 1.00000
Cu1 Cu 0.32901 0.55862 0.36630 1.00000
Cu2 Cu 0.87758 0.50921 0.75784 1.00000
H1 H 0.45861 0.30643 0.53743 1.00000
H2 H 0.82061 0.56244 0.33580 1.00000
H3 H 0.39811 0.87756 0.49358 1.00000
H4 H 0.22791 0.27025 0.16667 1.00000
H5 H 0.01926 0.80739 0.70633 1.00000
H6 H 0.18545 0.77715 0.12199 1.00000
H7 H 0.62011 0.01439 0.95421 1.00000
H8 H 0.11340 0.23808 0.74627 1.00000
Rh1 Rh 0.11623 0.02081 0.94736 1.00000
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