Ac3(PdAu)4
Alexandria ALEXAlex-ID: agm003380945 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_25_spg71
AcAu2 Ac2Pd3Au4 Ac4Pd12Au
2022-02-09 05:18:01.779580
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003380945).
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 agm003380945
data_agm003380945
_cell_length_a 4.07105
_cell_length_b 4.43212
_cell_length_c 15.03685
_cell_angle_alpha 81.31166
_cell_angle_beta 82.45190
_cell_angle_gamma 90.02781
_cell_volume 265.82085
_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
Ac1 Ac 0.15200 0.65104 0.69914 1.00000
Ac2 Ac 0.84803 0.34898 0.30087 1.00000
Ac3 Ac 0.00002 0.00002 0.99998 1.00000
Pd1 Pd 0.54145 0.54502 0.90976 1.00000
Pd2 Pd 0.45857 0.45500 0.09024 1.00000
Pd3 Pd 0.31022 0.81261 0.37664 1.00000
Pd4 Pd 0.68981 0.18741 0.62337 1.00000
Au1 Au 0.59890 0.09855 0.80578 1.00000
Au2 Au 0.25362 0.25369 0.49232 1.00000
Au3 Au 0.74640 0.74633 0.50769 1.00000
Au4 Au 0.40112 0.90148 0.19422 1.00000
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