Pm5Pd5Au2
Alexandria ALEXAlex-ID: agm005666983 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_26_spg12
Pm3Pd3Au2 PmPd
2023-06-19 05:28:06.953665
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005666983).
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 agm005666983
data_agm005666983
_cell_length_a 4.18402
_cell_length_b 8.16169
_cell_length_c 8.86890
_cell_angle_alpha 92.48896
_cell_angle_beta 76.35639
_cell_angle_gamma 75.14812
_cell_volume 282.73709
_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
Pm1 Pm 0.00000 0.50000 0.50000 1.00000
Pm2 Pm 0.67801 0.72601 0.91798 1.00000
Pm3 Pm 0.37588 0.91774 0.33051 1.00000
Pm4 Pm 0.62413 0.08226 0.66949 1.00000
Pm5 Pm 0.32199 0.27399 0.08202 1.00000
Pd1 Pd 0.73101 0.19190 0.34607 1.00000
Pd2 Pd 0.93677 0.28613 0.84034 1.00000
Pd3 Pd 0.06323 0.71387 0.15966 1.00000
Pd4 Pd 0.26899 0.80810 0.65393 1.00000
Pd5 Pd 0.00000 0.00000 0.00000 1.00000
Au1 Au 0.37903 0.48366 0.75828 1.00000
Au2 Au 0.62097 0.51634 0.24172 1.00000
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