Ce3UMn5
Alexandria ALEXAlex-ID: agm072736644 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C5_1072_spg1
Ce Ce2UMn3 Mn
2024-09-26 00:55:07.721867
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm072736644).
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 agm072736644
data_agm072736644
_cell_length_a 4.73099
_cell_length_b 6.16518
_cell_length_c 5.99331
_cell_angle_alpha 91.08941
_cell_angle_beta 110.22993
_cell_angle_gamma 93.78299
_cell_volume 163.50504
_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
Ce1 Ce 0.47616 0.55782 0.16408 1.00000
Ce2 Ce 0.32539 0.37335 0.60402 1.00000
Ce3 Ce 0.03579 0.87672 0.33759 1.00000
U1 U 0.95240 0.12551 0.83778 1.00000
Mn1 Mn 0.41261 0.04643 0.01924 1.00000
Mn2 Mn 0.40618 0.86195 0.67219 1.00000
Mn3 Mn 0.64906 0.15097 0.46377 1.00000
Mn4 Mn 0.82745 0.35862 0.10920 1.00000
Mn5 Mn 0.91427 0.64886 0.79168 1.00000
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