Ce3Os
Alexandria ALEXAlex-ID: agm005543392 · Space group: P4_2/n (#86)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3_281_spg86
Ce7Os3 Ce
2023-05-29 00:20:36.486516
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005543392).
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 agm005543392
data_agm005543392
_cell_length_a 5.73399
_cell_length_b 11.72297
_cell_length_c 11.72297
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 788.01177
_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 0.99423 0.29665 0.83569 1.00000
Ce2 Ce 0.99423 0.70335 0.16431 1.00000
Ce3 Ce 0.49423 0.66431 0.79665 1.00000
Ce4 Ce 0.49423 0.33569 0.20335 1.00000
Ce5 Ce 0.50577 0.20335 0.66431 1.00000
Ce6 Ce 0.50577 0.79665 0.33569 1.00000
Ce7 Ce 0.00577 0.83569 0.70335 1.00000
Ce8 Ce 0.00577 0.16431 0.29665 1.00000
Ce9 Ce 0.55724 0.37082 0.91674 1.00000
Ce10 Ce 0.55724 0.62918 0.08326 1.00000
Ce11 Ce 0.05724 0.58326 0.87082 1.00000
Ce12 Ce 0.05724 0.41674 0.12918 1.00000
Ce13 Ce 0.94276 0.12918 0.58326 1.00000
Ce14 Ce 0.94276 0.87082 0.41674 1.00000
Ce15 Ce 0.44276 0.91674 0.62918 1.00000
Ce16 Ce 0.44276 0.08326 0.37082 1.00000
Ce17 Ce 0.74932 0.05491 0.86479 1.00000
Ce18 Ce 0.74932 0.94509 0.13521 1.00000
Ce19 Ce 0.24932 0.63521 0.55491 1.00000
Ce20 Ce 0.24932 0.36479 0.44509 1.00000
Ce21 Ce 0.75068 0.44509 0.63521 1.00000
Ce22 Ce 0.75068 0.55491 0.36479 1.00000
Ce23 Ce 0.25068 0.86479 0.94509 1.00000
Ce24 Ce 0.25068 0.13521 0.05491 1.00000
Os1 Os 0.76242 0.81086 0.92494 1.00000
Os2 Os 0.76242 0.18914 0.07506 1.00000
Os3 Os 0.26242 0.57506 0.31086 1.00000
Os4 Os 0.26242 0.42494 0.68914 1.00000
Os5 Os 0.73758 0.68914 0.57506 1.00000
Os6 Os 0.73758 0.31086 0.42494 1.00000
Os7 Os 0.23758 0.92494 0.18914 1.00000
Os8 Os 0.23758 0.07506 0.81086 1.00000
