CeEr2Bi3
Alexandria ALEXAlex-ID: agm033392071 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_32_spg12
CeEr5Bi6 CeErBi2
2024-12-08 05:51:45
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm033392071).
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 agm033392071
data_agm033392071
_cell_length_a 10.05470
_cell_length_b 10.05470
_cell_length_c 8.99840
_cell_angle_alpha 77.12105
_cell_angle_beta 102.87895
_cell_angle_gamma 154.09925
_cell_volume 386.84202
_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 0.83470 0.16530 0.66865 1.00000
Ce2 Ce 0.16530 0.83470 0.33135 1.00000
Er1 Er 0.50000 0.50000 0.50000 1.00000
Er2 Er 0.83225 0.16775 0.16603 1.00000
Er3 Er 0.16775 0.83225 0.83397 1.00000
Er4 Er 0.50000 0.50000 0.00000 1.00000
Bi1 Bi 0.33400 0.66600 0.92363 1.00000
Bi2 Bi 0.66500 0.33500 0.58804 1.00000
Bi3 Bi 0.66600 0.33400 0.07637 1.00000
Bi4 Bi 0.99710 0.00290 0.24850 1.00000
Bi5 Bi 0.00290 0.99710 0.75150 1.00000
Bi6 Bi 0.33500 0.66500 0.41196 1.00000
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