K3(CdSn2)2
Alexandria ALEXAlex-ID: agm003332467 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_370_spg12
K2CdSn3 KCd11 KSn
2022-01-29 16:57:20.346106
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003332467).
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 agm003332467
data_agm003332467
_cell_length_a 4.85757
_cell_length_b 7.11916
_cell_length_c 11.01010
_cell_angle_alpha 64.51906
_cell_angle_beta 77.43267
_cell_angle_gamma 70.08593
_cell_volume 322.02589
_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
K1 K 0.63450 0.12113 0.61130 1.00000
K2 K 0.00000 0.00000 0.00000 1.00000
K3 K 0.36550 0.87887 0.38870 1.00000
Cd1 Cd 0.65374 0.47248 0.22113 1.00000
Cd2 Cd 0.34626 0.52752 0.77887 1.00000
Sn1 Sn 0.28625 0.34826 0.08188 1.00000
Sn2 Sn 0.92063 0.51643 0.64026 1.00000
Sn3 Sn 0.07937 0.48357 0.35974 1.00000
Sn4 Sn 0.71375 0.65174 0.91812 1.00000
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