Pr3Cd3Au8
Alexandria ALEXAlex-ID: agm003376014 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C8_19_spg12
Pr(CdAu2)2 Pr4Cd3Au10 Cd3Au
2022-02-08 23:37:35.589206
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003376014).
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 agm003376014
data_agm003376014
_cell_length_a 4.55435
_cell_length_b 8.88162
_cell_length_c 8.88162
_cell_angle_alpha 69.50400
_cell_angle_beta 75.14393
_cell_angle_gamma 75.14393
_cell_volume 319.71434
_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 0.50000 0.50000 0.50000 1.00000
Pr2 Pr 0.78860 0.21140 0.21140 1.00000
Pr3 Pr 0.21140 0.78860 0.78860 1.00000
Cd1 Cd 0.50000 0.00000 0.00000 1.00000
Cd2 Cd 0.00000 0.81137 0.18863 1.00000
Cd3 Cd 0.00000 0.18863 0.81137 1.00000
Au1 Au 0.64034 0.06455 0.65478 1.00000
Au2 Au 0.35966 0.93545 0.34522 1.00000
Au3 Au 0.64034 0.65478 0.06455 1.00000
Au4 Au 0.35966 0.34522 0.93545 1.00000
Au5 Au 0.84495 0.78877 0.52134 1.00000
Au6 Au 0.15505 0.21123 0.47866 1.00000
Au7 Au 0.84495 0.52134 0.78877 1.00000
Au8 Au 0.15505 0.47866 0.21123 1.00000
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