La2AlSn2
Alexandria ALEXAlex-ID: agm005961533 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_43_spg12
La2Sn3 LaAl3 LaSn
2023-08-03 10:16:58.225076
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005961533).
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 agm005961533
data_agm005961533
_cell_length_a 4.62396
_cell_length_b 6.40525
_cell_length_c 10.79109
_cell_angle_alpha 83.61932
_cell_angle_beta 77.62853
_cell_angle_gamma 68.84141
_cell_volume 290.93825
_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 0.69937 0.25332 0.34794 1.00000
La2 La 0.90314 0.28711 0.90661 1.00000
La3 La 0.30063 0.74668 0.65206 1.00000
La4 La 0.09686 0.71289 0.09339 1.00000
Al1 Al 0.54493 0.20293 0.70721 1.00000
Al2 Al 0.45507 0.79707 0.29279 1.00000
Sn1 Sn 0.06220 0.29570 0.57991 1.00000
Sn2 Sn 0.64046 0.84314 0.87594 1.00000
Sn3 Sn 0.93780 0.70430 0.42009 1.00000
Sn4 Sn 0.35954 0.15686 0.12406 1.00000
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