Fe2Pd2Pt
Alexandria ALEXAlex-ID: agm044152985 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_310_spg139
Fe2Pd2Pt
2024-09-13 13:41:58.182657
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm044152985).
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 agm044152985
data_agm044152985
_cell_length_a 9.66904
_cell_length_b 9.66904
_cell_length_c 9.66904
_cell_angle_alpha 163.68640
_cell_angle_beta 163.68640
_cell_angle_gamma 23.15022
_cell_volume 71.30902
_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 0.59849 0.59849 0.00000 1.00000
Fe2 Fe 0.40151 0.40151 0.00000 1.00000
Pd1 Pd 0.80531 0.80531 0.00000 1.00000
Pd2 Pd 0.19469 0.19469 0.00000 1.00000
Pt1 Pt 0.00000 0.00000 0.00000 1.00000
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