Sr4Pd2Au
Alexandria ALEXAlex-ID: agm005994817 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_1167_spg8
Sr3Au2 Sr2PdAu Sr3Pd2
2023-10-16 03:03:02
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005994817).
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 agm005994817
data_agm005994817
_cell_length_a 7.73368
_cell_length_b 7.73370
_cell_length_c 8.35621
_cell_angle_alpha 105.48879
_cell_angle_beta 105.48889
_cell_angle_gamma 74.49711
_cell_volume 453.69036
_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 0.11935 0.11926 0.83143 1.00000
Sr2 Sr 0.62043 0.62045 0.34249 1.00000
Sr3 Sr 0.12620 0.12618 0.34235 1.00000
Sr4 Sr 0.62623 0.14234 0.97104 1.00000
Sr5 Sr 0.14227 0.62616 0.97106 1.00000
Sr6 Sr 0.61521 0.61529 0.82720 1.00000
Sr7 Sr 0.15347 0.64085 0.47444 1.00000
Sr8 Sr 0.64088 0.15349 0.47446 1.00000
Pd1 Pd 0.33324 0.33326 0.69475 1.00000
Pd2 Pd 0.33978 0.33973 0.19600 1.00000
Pd3 Pd 0.93051 0.42964 0.61711 1.00000
Pd4 Pd 0.42966 0.93053 0.61710 1.00000
Au1 Au 0.83665 0.83669 0.19425 1.00000
Au2 Au 0.83613 0.83611 0.69633 1.00000
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