Cd5Cu3
Alexandria ALEXAlex-ID: agm003218166 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B5_0_spg140
Cu Cd
2021-12-06 07:59:20.238800
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003218166).
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 agm003218166
data_agm003218166
_cell_length_a 5.38847
_cell_length_b 7.64446
_cell_length_c 7.64548
_cell_angle_alpha 93.44055
_cell_angle_beta 106.22547
_cell_angle_gamma 73.77668
_cell_volume 290.29119
_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
Cd1 Cd 0.04773 0.69252 0.87739 1.00000
Cd2 Cd 0.21370 0.83785 0.28898 1.00000
Cd3 Cd 0.25014 0.47357 0.47345 1.00000
Cd4 Cd 0.28694 0.28866 0.83784 1.00000
Cd5 Cd 0.45280 0.87688 0.69280 1.00000
Cd6 Cd 0.54799 0.12317 0.30814 1.00000
Cd7 Cd 0.71378 0.71135 0.16291 1.00000
Cd8 Cd 0.75057 0.52644 0.52735 1.00000
Cd9 Cd 0.78721 0.16203 0.71187 1.00000
Cd10 Cd 0.95306 0.30756 0.12340 1.00000
Cu1 Cu 0.07838 0.15480 0.47219 1.00000
Cu2 Cu 0.25073 0.99013 0.99055 1.00000
Cu3 Cu 0.42252 0.47199 0.15493 1.00000
Cu4 Cu 0.57829 0.52797 0.84584 1.00000
Cu5 Cu 0.75030 0.00992 0.01052 1.00000
Cu6 Cu 0.92254 0.84514 0.52851 1.00000
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