Y(Al2Sn3)2
Alexandria ALEXAlex-ID: agm002196360 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C6_73_spg8
YSn3 Sn Al
2023-03-24 04:04:25.286176
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002196360).
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 agm002196360
data_agm002196360
_cell_length_a 6.07361
_cell_length_b 6.07364
_cell_length_c 8.56525
_cell_angle_alpha 109.99279
_cell_angle_beta 109.99725
_cell_angle_gamma 90.29303
_cell_volume 276.34258
_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
Y1 Y 0.99995 0.99994 0.99997 1.00000
Sn1 Sn 0.41074 0.92193 0.34218 1.00000
Sn2 Sn 0.92194 0.41071 0.34214 1.00000
Sn3 Sn 0.07907 0.07909 0.65705 1.00000
Sn4 Sn 0.50019 0.00123 0.00019 1.00000
Sn5 Sn 0.58744 0.58751 0.65878 1.00000
Sn6 Sn 0.00123 0.50009 0.00003 1.00000
Al1 Al 0.58852 0.13516 0.71585 1.00000
Al2 Al 0.41429 0.41434 0.28387 1.00000
Al3 Al 0.13513 0.58862 0.71581 1.00000
Al4 Al 0.86133 0.86122 0.28431 1.00000
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