LaCe3(ErBi2)4
Alexandria ALEXAlex-ID: agm053374469 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4D8_63_spg12
CeEr5Bi6 CeErBi2 La4CeBi5
2024-11-02 00:33:12.334750
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm053374469).
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 agm053374469
data_agm053374469
_cell_length_a 9.06222
_cell_length_b 9.06222
_cell_length_c 9.06222
_cell_angle_alpha 60.25233
_cell_angle_beta 60.25233
_cell_angle_gamma 60.25233
_cell_volume 529.25241
_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
La1 La 0.00000 0.00000 0.00000 1.00000
Ce1 Ce 0.50000 0.50000 0.00000 1.00000
Ce2 Ce 0.50000 0.00000 0.50000 1.00000
Ce3 Ce 0.00000 0.50000 0.50000 1.00000
Er1 Er 0.50000 0.50000 0.50000 1.00000
Er2 Er 0.50000 0.00000 0.00000 1.00000
Er3 Er 0.00000 0.00000 0.50000 1.00000
Er4 Er 0.00000 0.50000 0.00000 1.00000
Bi1 Bi 0.74496 0.24922 0.74496 1.00000
Bi2 Bi 0.74496 0.74496 0.24922 1.00000
Bi3 Bi 0.75306 0.75306 0.75306 1.00000
Bi4 Bi 0.24922 0.74496 0.74496 1.00000
Bi5 Bi 0.75078 0.25504 0.25504 1.00000
Bi6 Bi 0.24694 0.24694 0.24694 1.00000
Bi7 Bi 0.25504 0.25504 0.75078 1.00000
Bi8 Bi 0.25504 0.75078 0.25504 1.00000
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