La10(SnSb)3
Alexandria ALEXAlex-ID: agm005669014 · Space group: P-62m (#189)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C10_0_spg189
La5Sb3 La5Sn3
2023-06-19 15:22:34.378228
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005669014).
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 agm005669014
data_agm005669014
_cell_length_a 6.73604
_cell_length_b 9.59541
_cell_length_c 9.59541
_cell_angle_alpha 120.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 537.10954
_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 0.24473 0.66667 0.33333 1.00000
La2 La 0.24473 0.33333 0.66667 1.00000
La3 La 0.75527 0.33333 0.66667 1.00000
La4 La 0.75527 0.66667 0.33333 1.00000
La5 La 0.50000 0.00000 0.74388 1.00000
La6 La 0.50000 0.74388 1.00000 1.00000
La7 La 0.50000 0.25612 0.25612 1.00000
La8 La 0.00000 0.00000 0.25433 1.00000
La9 La 0.00000 0.25433 0.00000 1.00000
La10 La 0.00000 0.74567 0.74567 1.00000
Sn1 Sn 0.50000 0.00000 0.38476 1.00000
Sn2 Sn 0.50000 0.38476 0.00000 1.00000
Sn3 Sn 0.50000 0.61524 0.61524 1.00000
Sb1 Sb 0.00000 0.00000 0.61694 1.00000
Sb2 Sb 0.00000 0.61694 1.00000 1.00000
Sb3 Sb 0.00000 0.38306 0.38306 1.00000
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