Dy2AlCd3
Alexandria ALEXAlex-ID: agm005809796 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_769_spg69
DyCd2 DyAl2
2023-08-07 03:42:05.468592
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005809796).
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 agm005809796
data_agm005809796
_cell_length_a 5.97626
_cell_length_b 5.97626
_cell_length_c 9.10492
_cell_angle_alpha 102.98177
_cell_angle_beta 102.98177
_cell_angle_gamma 108.39174
_cell_volume 284.92205
_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
Dy1 Dy 0.25000 0.75000 0.50000 1.00000
Dy2 Dy 0.75131 0.75131 1.00000 1.00000
Dy3 Dy 0.75000 0.25000 0.50000 1.00000
Dy4 Dy 0.24869 0.24869 0.00000 1.00000
Al1 Al 0.33346 0.33346 0.66692 1.00000
Al2 Al 0.66654 0.66654 0.33308 1.00000
Cd1 Cd 0.66050 0.17028 0.83079 1.00000
Cd2 Cd 0.82972 0.33950 0.16921 1.00000
Cd3 Cd 0.33950 0.82972 0.16921 1.00000
Cd4 Cd 0.17028 0.66050 0.83079 1.00000
Cd5 Cd 0.83036 0.83036 0.66071 1.00000
Cd6 Cd 0.16964 0.16964 0.33929 1.00000
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