Cs3(CdTe2)2
Alexandria ALEXAlex-ID: agm005647350 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_39_spg12
Cs2Cd3Te4 Cs2CdTe2 Cs2Te5
2023-06-26 20:19:33.254972
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005647350).
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 agm005647350
data_agm005647350
_cell_length_a 4.96808
_cell_length_b 8.91747
_cell_length_c 10.29658
_cell_angle_alpha 113.90936
_cell_angle_beta 103.91864
_cell_angle_gamma 90.02189
_cell_volume 402.30737
_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
Cs1 Cs 0.13338 0.55038 0.26800 1.00000
Cs2 Cs 0.86662 0.44962 0.73200 1.00000
Cs3 Cs 0.00000 0.00000 0.00000 1.00000
Cd1 Cd 0.67066 0.95333 0.34091 1.00000
Cd2 Cd 0.32934 0.04667 0.65909 1.00000
Te1 Te 0.52411 0.70171 0.04749 1.00000
Te2 Te 0.21023 0.15773 0.41985 1.00000
Te3 Te 0.47589 0.29829 0.95251 1.00000
Te4 Te 0.78977 0.84227 0.58015 1.00000
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