Ca2Cd2Sn
Alexandria ALEXAlex-ID: agm003402995 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_497_spg12
Ca2CdSn CaCd2 CaCdSn
2022-02-19 15:50:51.303314
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003402995).
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 agm003402995
data_agm003402995
_cell_length_a 4.68166
_cell_length_b 6.23009
_cell_length_c 10.92163
_cell_angle_alpha 89.95054
_cell_angle_beta 77.62380
_cell_angle_gamma 67.93059
_cell_volume 287.23289
_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
Ca1 Ca 0.67679 0.31110 0.33533 1.00000
Ca2 Ca 0.92037 0.26732 0.89193 1.00000
Ca3 Ca 0.32321 0.68890 0.66467 1.00000
Ca4 Ca 0.07963 0.73268 0.10807 1.00000
Cd1 Cd 0.08751 0.27381 0.55118 1.00000
Cd2 Cd 0.64180 0.82564 0.89077 1.00000
Cd3 Cd 0.91249 0.72619 0.44882 1.00000
Cd4 Cd 0.35820 0.17436 0.10923 1.00000
Sn1 Sn 0.60579 0.11102 0.67739 1.00000
Sn2 Sn 0.39421 0.88898 0.32261 1.00000
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