La2Al5Ag4
Alexandria ALEXAlex-ID: agm005652942 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_154_spg69
LaAl3Ag La2(AlAg)5 La3Al7Ag2
2023-06-21 09:50:25.851481
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005652942).
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
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# CIF generated by HEAS from Alexandria entry agm005652942
data_agm005652942
_cell_length_a 5.58298
_cell_length_b 5.62442
_cell_length_c 9.08094
_cell_angle_alpha 81.22423
_cell_angle_beta 72.09733
_cell_angle_gamma 60.24345
_cell_volume 235.56497
_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
La1 La 0.88164 1.00000 0.23673 1.00000
La2 La 0.11836 0.00000 0.76327 1.00000
Al1 Al 0.50000 0.00000 0.00000 1.00000
Al2 Al 0.00000 0.50000 0.00000 1.00000
Al3 Al 0.50000 0.50000 0.00000 1.00000
Al4 Al 0.25000 0.50000 0.50000 1.00000
Al5 Al 0.75000 0.50000 0.50000 1.00000
Ag1 Ag 0.79306 0.67566 0.73823 1.00000
Ag2 Ag 0.20694 0.32434 0.26177 1.00000
Ag3 Ag 0.53129 0.67566 0.26177 1.00000
Ag4 Ag 0.46871 0.32434 0.73823 1.00000
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