Ce2YSbN5
Alexandria ALEXAlex-ID: agm005152865 · Space group: Cmc2_1 (#36)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D5_216_spg36
CeN2 CeSbN YN SbN
2023-01-17 02:06:11.168726
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005152865).
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 agm005152865
data_agm005152865
_cell_length_a 3.49050
_cell_length_b 7.24255
_cell_length_c 10.67015
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 103.94391
_cell_volume 261.79453
_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 0.85837 0.71674 0.77897 1.00000
Ce2 Ce 0.11373 0.22746 0.69432 1.00000
Ce3 Ce 0.14163 0.28326 0.27897 1.00000
Ce4 Ce 0.88627 0.77254 0.19432 1.00000
Y1 Y 0.77918 0.55836 0.49951 1.00000
Y2 Y 0.22082 0.44164 0.99951 1.00000
Sb1 Sb 0.52375 0.04751 0.96326 1.00000
Sb2 Sb 0.47625 0.95249 0.46326 1.00000
N1 N 0.37989 0.75979 0.01601 1.00000
N2 N 0.67411 0.34822 0.86399 1.00000
N3 N 0.48566 0.97131 0.77851 1.00000
N4 N 0.27972 0.55943 0.66621 1.00000
N5 N 0.94624 0.89247 0.56319 1.00000
N6 N 0.62011 0.24021 0.51601 1.00000
N7 N 0.32589 0.65178 0.36399 1.00000
N8 N 0.51434 0.02869 0.27851 1.00000
N9 N 0.72028 0.44057 0.16621 1.00000
N10 N 0.05376 0.10753 0.06319 1.00000
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