Ce8Sb4Te3Br
Alexandria ALEXAlex-ID: agm063483776 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4D8_20_spg12
Ce3SbTe2 Ce2SbTe Ce5Sb3Br Ce2Br5
2025-03-25 05:01:32
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm063483776).
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 agm063483776
data_agm063483776
_cell_length_a 8.91495
_cell_length_b 8.91495
_cell_length_c 8.91495
_cell_angle_alpha 60.82406
_cell_angle_beta 60.82406
_cell_angle_gamma 60.82406
_cell_volume 510.31504
_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 0.75132 0.25110 0.25110 1.00000
Ce2 Ce 0.25110 0.75132 0.25110 1.00000
Ce3 Ce 0.24879 0.24879 0.24879 1.00000
Ce4 Ce 0.25110 0.25110 0.75132 1.00000
Ce5 Ce 0.74890 0.74890 0.24868 1.00000
Ce6 Ce 0.75121 0.75121 0.75121 1.00000
Ce7 Ce 0.74890 0.24868 0.74890 1.00000
Ce8 Ce 0.24868 0.74890 0.74890 1.00000
Sb1 Sb 0.50000 0.50000 0.50000 1.00000
Sb2 Sb 0.00000 0.00000 0.50000 1.00000
Sb3 Sb 0.00000 0.50000 0.00000 1.00000
Sb4 Sb 0.50000 0.00000 0.00000 1.00000
Te1 Te 0.50000 0.00000 0.50000 1.00000
Te2 Te 0.00000 0.50000 0.50000 1.00000
Te3 Te 0.50000 0.50000 0.00000 1.00000
Br1 Br 0.00000 0.00000 0.00000 1.00000
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