SrCdSn2
Alexandria ALEXAlex-ID: agm005753443 · Space group: Pnma (#62)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_9189_spg62
SrSn3 Sr3(CdSn)4 Sn
2023-07-13 17:04:12.870801
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005753443).
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 agm005753443
data_agm005753443
_cell_length_a 4.89752
_cell_length_b 12.51840
_cell_length_c 15.76724
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 966.67491
_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 0.75000 0.46114 0.70584 1.00000
Sr2 Sr 0.25000 0.96114 0.79416 1.00000
Sr3 Sr 0.25000 0.53886 0.29416 1.00000
Sr4 Sr 0.75000 0.03886 0.20584 1.00000
Sr5 Sr 0.75000 0.26277 0.95696 1.00000
Sr6 Sr 0.25000 0.76277 0.54304 1.00000
Sr7 Sr 0.25000 0.73723 0.04304 1.00000
Sr8 Sr 0.75000 0.23723 0.45696 1.00000
Cd1 Cd 0.75000 0.54859 0.94469 1.00000
Cd2 Cd 0.25000 0.04859 0.55531 1.00000
Cd3 Cd 0.25000 0.45141 0.05531 1.00000
Cd4 Cd 0.75000 0.95141 0.44469 1.00000
Cd5 Cd 0.75000 0.32101 0.21066 1.00000
Cd6 Cd 0.25000 0.82101 0.28934 1.00000
Cd7 Cd 0.25000 0.67899 0.78934 1.00000
Cd8 Cd 0.75000 0.17899 0.71066 1.00000
Sn1 Sn 0.75000 0.99545 0.94609 1.00000
Sn2 Sn 0.25000 0.49545 0.55391 1.00000
Sn3 Sn 0.25000 0.00455 0.05391 1.00000
Sn4 Sn 0.75000 0.50455 0.44609 1.00000
Sn5 Sn 0.75000 0.77226 0.88902 1.00000
Sn6 Sn 0.25000 0.27226 0.61098 1.00000
Sn7 Sn 0.25000 0.22774 0.11098 1.00000
Sn8 Sn 0.75000 0.72774 0.38902 1.00000
Sn9 Sn 0.75000 0.74283 0.69669 1.00000
Sn10 Sn 0.25000 0.24283 0.80331 1.00000
Sn11 Sn 0.25000 0.25717 0.30331 1.00000
Sn12 Sn 0.75000 0.75717 0.19669 1.00000
Sn13 Sn 0.75000 0.96360 0.63536 1.00000
Sn14 Sn 0.25000 0.46360 0.86464 1.00000
Sn15 Sn 0.25000 0.03640 0.36464 1.00000
Sn16 Sn 0.75000 0.53640 0.13536 1.00000
