Ce8Zn4C
Alexandria ALEXAlex-ID: agm097920544 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_213_spg2
CeZn Ce Ce2C3
2025-06-20 22:50:31
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097920544).
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 agm097920544
data_agm097920544
_cell_length_a 3.90488
_cell_length_b 9.14807
_cell_length_c 9.14521
_cell_angle_alpha 68.85137
_cell_angle_beta 81.85695
_cell_angle_gamma 81.84768
_cell_volume 300.15169
_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 0.48142 0.20633 0.20664 1.00000
Ce2 Ce 0.31623 0.61696 0.12109 1.00000
Ce3 Ce 0.47973 0.70552 0.70593 1.00000
Ce4 Ce 0.31628 0.12080 0.61729 1.00000
Ce5 Ce 0.52362 0.79274 0.28003 1.00000
Ce6 Ce 0.67266 0.37475 0.37456 1.00000
Ce7 Ce 0.52380 0.28032 0.79236 1.00000
Ce8 Ce 0.65925 0.87341 0.87336 1.00000
Zn1 Zn 0.05535 0.03014 0.02917 1.00000
Zn2 Zn 0.93344 0.46104 0.95321 1.00000
Zn3 Zn 0.06116 0.53721 0.53667 1.00000
Zn4 Zn 0.93334 0.95269 0.46162 1.00000
C1 C 0.54373 0.04808 0.04806 1.00000
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