Ce2FeOs3
Alexandria ALEXAlex-ID: agm005687464 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_8_spg166
Ce2FeOs3
2023-08-17 18:17:20.015366
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005687464).
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 agm005687464
data_agm005687464
_cell_length_a 5.24645
_cell_length_b 5.24645
_cell_length_c 5.24645
_cell_angle_alpha 62.15421
_cell_angle_beta 62.15418
_cell_angle_gamma 62.15418
_cell_volume 107.02805
_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 0.37761 0.37761 0.37761 1.00000
Ce2 Ce 0.62239 0.62239 0.62239 1.00000
Fe1 Fe 0.00000 0.00000 0.00000 1.00000
Os1 Os 0.00000 0.00000 0.50000 1.00000
Os2 Os 0.50000 0.00000 0.00000 1.00000
Os3 Os 0.00000 0.50000 0.00000 1.00000
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