U3(InRu)2
Alexandria ALEXAlex-ID: agm010114879 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_22_spg12
U4Ru3 U2Ru In
2024-03-07 16:51:04.251504
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010114879).
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 agm010114879
data_agm010114879
_cell_length_a 5.96182
_cell_length_b 5.96182
_cell_length_c 11.06454
_cell_angle_alpha 50.54788
_cell_angle_beta 50.54788
_cell_angle_gamma 29.73987
_cell_volume 146.99731
_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 0.50000 0.50000 0.00000 1.00000
U2 U 0.87945 0.87945 0.51988 1.00000
U3 U 0.12055 0.12055 0.48012 1.00000
In1 In 0.33799 0.33799 0.81877 1.00000
In2 In 0.66201 0.66201 0.18123 1.00000
Ru1 Ru 0.89304 0.89304 0.27321 1.00000
Ru2 Ru 0.10696 0.10696 0.72679 1.00000
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