Ac3CdPd3
Alexandria ALEXAlex-ID: agm048014510 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C3_2373_spg5
Ac2CdPd2 AcPd
2025-06-26 07:30:21
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm048014510).
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
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# CIF generated by HEAS from Alexandria entry agm048014510
data_agm048014510
_cell_length_a 11.03914
_cell_length_b 11.03914
_cell_length_c 4.40417
_cell_angle_alpha 78.49568
_cell_angle_beta 101.50432
_cell_angle_gamma 157.76702
_cell_volume 198.83577
_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 0.18781 0.81219 0.69066 1.00000
Ac2 Ac 0.81817 0.18183 0.32065 1.00000
Ac3 Ac 0.98205 0.01795 0.98369 1.00000
Cd1 Cd 0.56398 0.43602 0.56548 1.00000
Pd1 Pd 0.34379 0.65621 0.84608 1.00000
Pd2 Pd 0.65641 0.34359 0.15882 1.00000
Pd3 Pd 0.43286 0.56714 0.43463 1.00000
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