Sr3Sn5
Alexandria ALEXAlex-ID: agm005535166 · Space group: Fdd2 (#43)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B5_393_spg43
Sr3Sn5
2023-05-28 02:30:37.630523
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005535166).
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 agm005535166
data_agm005535166
_cell_length_a 6.68117
_cell_length_b 8.65811
_cell_length_c 10.56873
_cell_angle_alpha 82.99507
_cell_angle_beta 71.57388
_cell_angle_gamma 67.30455
_cell_volume 535.10707
_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
Sr1 Sr 0.96469 0.38791 0.65875 1.00000
Sr2 Sr 0.64739 0.38791 0.34125 1.00000
Sr3 Sr 0.87344 0.88791 0.84125 1.00000
Sr4 Sr 0.23865 0.88791 0.15875 1.00000
Sr5 Sr 0.55101 0.89798 0.50000 1.00000
Sr6 Sr 0.30101 0.39798 0.00000 1.00000
Sn1 Sn 0.47944 0.72309 0.83103 1.00000
Sn2 Sn 0.79747 0.72309 0.16897 1.00000
Sn3 Sn 0.56047 0.22309 0.66897 1.00000
Sn4 Sn 0.21644 0.22309 0.33103 1.00000
Sn5 Sn 0.67772 0.08374 0.14691 1.00000
Sn6 Sn 0.23854 0.08374 0.85309 1.00000
Sn7 Sn 0.07463 0.58374 0.35309 1.00000
Sn8 Sn 0.34162 0.58374 0.64691 1.00000
Sn9 Sn 0.00224 0.99553 0.50000 1.00000
Sn10 Sn 0.75224 0.49553 0.00000 1.00000
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