Al2Zn2Pd7
Alexandria ALEXAlex-ID: agm003324399 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C7_271_spg2
AlZn2Pd5 AlPd2
2022-01-24 02:23:40.134436
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003324399).
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 agm003324399
data_agm003324399
_cell_length_a 6.42638
_cell_length_b 5.63155
_cell_length_c 4.99119
_cell_angle_alpha 102.37741
_cell_angle_beta 95.82827
_cell_angle_gamma 109.93716
_cell_volume 162.83331
_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
Al1 Al 0.72692 0.56098 0.64706 1.00000
Al2 Al 0.27308 0.43902 0.35294 1.00000
Zn1 Zn 0.80572 0.34181 0.06815 1.00000
Zn2 Zn 0.19428 0.65819 0.93185 1.00000
Pd1 Pd 0.91306 0.22630 0.54674 1.00000
Pd2 Pd 0.64001 0.70901 0.21032 1.00000
Pd3 Pd 0.08694 0.77370 0.45326 1.00000
Pd4 Pd 0.35999 0.29099 0.78968 1.00000
Pd5 Pd 0.00000 0.00000 0.00000 1.00000
Pd6 Pd 0.53906 0.88772 0.72801 1.00000
Pd7 Pd 0.46094 0.11228 0.27199 1.00000
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