AcCeCd4
Alexandria ALEXAlex-ID: agm005777949 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_1196_spg71
AcCd2 CeCd2
2023-07-27 18:54:31.680458
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005777949).
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 agm005777949
data_agm005777949
_cell_length_a 5.12606
_cell_length_b 6.28770
_cell_length_c 6.28778
_cell_angle_alpha 69.99607
_cell_angle_beta 65.94453
_cell_angle_gamma 65.94422
_cell_volume 165.18456
_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
Ac1 Ac 0.00000 0.00000 0.50000 1.00000
Ce1 Ce 0.00000 0.50000 0.00000 1.00000
Cd1 Cd 0.66634 0.56855 0.59877 1.00000
Cd2 Cd 0.33366 0.43145 0.40123 1.00000
Cd3 Cd 0.33364 0.90151 0.93120 1.00000
Cd4 Cd 0.66636 0.09849 0.06880 1.00000
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