Sr8Pd3Au2
Alexandria ALEXAlex-ID: agm005642640 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C8_146_spg65
Sr3Au2 Sr3Pd2 Sr7Pd3
2023-06-16 10:37:14.272681
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005642640).
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 agm005642640
data_agm005642640
_cell_length_a 5.34420
_cell_length_b 10.73166
_cell_length_c 9.33967
_cell_angle_alpha 125.27719
_cell_angle_beta 90.00205
_cell_angle_gamma 89.99999
_cell_volume 437.28720
_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
Sr1 Sr 1.00000 0.62241 0.24432 1.00000
Sr2 Sr 0.00000 0.37759 0.75568 1.00000
Sr3 Sr 0.00000 0.11965 0.23868 1.00000
Sr4 Sr 1.00000 0.88035 0.76132 1.00000
Sr5 Sr 0.50000 0.63313 0.75828 1.00000
Sr6 Sr 0.50000 0.12484 0.75844 1.00000
Sr7 Sr 0.50000 0.87516 0.24156 1.00000
Sr8 Sr 0.50000 0.36687 0.24172 1.00000
Pd1 Pd 0.50000 0.00000 0.00000 1.00000
Pd2 Pd 1.00000 0.25232 0.99999 1.00000
Pd3 Pd 0.00000 0.74768 0.00001 1.00000
Au1 Au 0.49999 0.25203 0.50396 1.00000
Au2 Au 0.50001 0.74797 0.49604 1.00000
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