Fe(CuPd2)2
Alexandria ALEXAlex-ID: agm024387311 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_415_spg12
FeCuPd4 FeCu5Pd6 FePd2
2025-06-12 02:20:05
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024387311).
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 agm024387311
data_agm024387311
_cell_length_a 4.58918
_cell_length_b 4.58918
_cell_length_c 6.19244
_cell_angle_alpha 79.55369
_cell_angle_beta 100.44631
_cell_angle_gamma 129.10296
_cell_volume 99.14351
_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
Fe1 Fe 0.00000 0.00000 0.00000 1.00000
Cu1 Cu 0.42665 0.57335 0.29209 1.00000
Cu2 Cu 0.57335 0.42665 0.70791 1.00000
Pd1 Pd 0.29154 0.70846 0.86490 1.00000
Pd2 Pd 0.70846 0.29154 0.13510 1.00000
Pd3 Pd 0.86227 0.13773 0.58276 1.00000
Pd4 Pd 0.13773 0.86227 0.41724 1.00000
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