Pr5U4
Alexandria ALEXAlex-ID: agm012452207 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A4B5_32_spg164
U Pr
2024-07-13 06:28:41.769806
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm012452207).
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 agm012452207
data_agm012452207
_cell_length_a 5.45776
_cell_length_b 5.45776
_cell_length_c 10.18106
_cell_angle_alpha 84.24786
_cell_angle_beta 84.24786
_cell_angle_gamma 64.30596
_cell_volume 271.35741
_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
Pr1 Pr 0.65934 0.65934 0.07683 1.00000
Pr2 Pr 0.00000 0.00000 0.50000 1.00000
Pr3 Pr 0.34066 0.34066 0.92317 1.00000
Pr4 Pr 0.69475 0.69475 0.71777 1.00000
Pr5 Pr 0.30525 0.30525 0.28223 1.00000
U1 U 0.38784 0.38784 0.57296 1.00000
U2 U 0.98719 0.98719 0.11756 1.00000
U3 U 0.01281 0.01281 0.88244 1.00000
U4 U 0.61216 0.61216 0.42704 1.00000
Get direct link