CeSm7Bi8
Alexandria ALEXAlex-ID: agm044753535 · Space group: Fm-3m (#225)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB7C8_4_spg225
CeSm5Bi6 SmBi
2024-08-24 23:43:45.155859
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm044753535).
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 agm044753535
data_agm044753535
_cell_length_a 9.13030
_cell_length_b 9.13030
_cell_length_c 9.13030
_cell_angle_alpha 60.00000
_cell_angle_beta 60.00000
_cell_angle_gamma 60.00000
_cell_volume 538.19582
_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 0.50000 0.50000 0.50000 1.00000
Sm1 Sm 0.00000 0.00000 0.00000 1.00000
Sm2 Sm 0.00000 0.50000 0.00000 1.00000
Sm3 Sm 0.50000 0.50000 0.00000 1.00000
Sm4 Sm 0.50000 0.00000 0.00000 1.00000
Sm5 Sm 0.00000 0.00000 0.50000 1.00000
Sm6 Sm 0.00000 0.50000 0.50000 1.00000
Sm7 Sm 0.50000 0.00000 0.50000 1.00000
Bi1 Bi 0.75007 0.24993 0.24993 1.00000
Bi2 Bi 0.75007 0.75007 0.24993 1.00000
Bi3 Bi 0.75000 0.75000 0.75000 1.00000
Bi4 Bi 0.24993 0.75007 0.24993 1.00000
Bi5 Bi 0.75007 0.24993 0.75007 1.00000
Bi6 Bi 0.25000 0.25000 0.25000 1.00000
Bi7 Bi 0.24993 0.24993 0.75007 1.00000
Bi8 Bi 0.24993 0.75007 0.75007 1.00000
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