Fe2Pd2Rh5
Alexandria ALEXAlex-ID: agm009852969 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_277_spg12
FeRh7 FePd2 FeRh3
2024-03-12 01:06:16.620549
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009852969).
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 agm009852969
data_agm009852969
_cell_length_a 4.70196
_cell_length_b 4.70196
_cell_length_c 8.12731
_cell_angle_alpha 73.06966
_cell_angle_beta 73.06966
_cell_angle_gamma 48.15619
_cell_volume 126.86528
_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 0.66736 0.66736 0.77766 1.00000
Fe2 Fe 0.33264 0.33264 0.22234 1.00000
Pd1 Pd 0.99836 0.99836 0.67127 1.00000
Pd2 Pd 0.00164 0.00164 0.32873 1.00000
Rh1 Rh 0.66897 0.66897 0.10660 1.00000
Rh2 Rh 0.33103 0.33103 0.89340 1.00000
Rh3 Rh 0.33096 0.33096 0.55586 1.00000
Rh4 Rh 0.66904 0.66904 0.44414 1.00000
Rh5 Rh 0.00000 0.00000 0.00000 1.00000
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