Pr2Ag5Pd4
Alexandria ALEXAlex-ID: agm003365769 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_154_spg69
Pr2AgPd5 Pr14Ag51 Ag
2022-02-05 11:07:55.299819
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003365769).
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 agm003365769
data_agm003365769
_cell_length_a 5.50215
_cell_length_b 5.36083
_cell_length_c 9.62446
_cell_angle_alpha 81.56493
_cell_angle_beta 73.39082
_cell_angle_gamma 59.12410
_cell_volume 233.48626
_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
Pr1 Pr 0.86729 0.00000 0.26541 1.00000
Pr2 Pr 0.13271 1.00000 0.73459 1.00000
Ag1 Ag 0.50000 0.00000 0.00000 1.00000
Ag2 Ag 0.00000 0.50000 0.00000 1.00000
Ag3 Ag 0.50000 0.50000 0.00000 1.00000
Ag4 Ag 0.25000 0.50000 0.50000 1.00000
Ag5 Ag 0.75000 0.50000 0.50000 1.00000
Pd1 Pd 0.46534 0.32406 0.74527 1.00000
Pd2 Pd 0.53466 0.67594 0.25473 1.00000
Pd3 Pd 0.21061 0.32406 0.25473 1.00000
Pd4 Pd 0.78939 0.67594 0.74527 1.00000
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