CdSn5Sb4
Alexandria ALEXAlex-ID: agm006089229 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C5_28_spg139
Sn4Sb3 CdSnSb2 Sn
2023-10-10 19:58:17
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006089229).
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 agm006089229
data_agm006089229
_cell_length_a 4.36843
_cell_length_b 4.36843
_cell_length_c 15.71232
_cell_angle_alpha 97.99074
_cell_angle_beta 97.99074
_cell_angle_gamma 89.99999
_cell_volume 293.98949
_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
Cd1 Cd 0.00000 0.00000 0.00000 1.00000
Sn1 Sn 0.10152 0.10152 0.20304 1.00000
Sn2 Sn 0.50000 0.50000 0.00000 1.00000
Sn3 Sn 0.89848 0.89848 0.79696 1.00000
Sn4 Sn 0.30011 0.30011 0.60022 1.00000
Sn5 Sn 0.69989 0.69989 0.39978 1.00000
Sb1 Sb 0.40039 0.40039 0.80079 1.00000
Sb2 Sb 0.80003 0.80003 0.60006 1.00000
Sb3 Sb 0.19997 0.19997 0.39994 1.00000
Sb4 Sb 0.59961 0.59961 0.19921 1.00000
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