CsTe2
Alexandria ALEXAlex-ID: agm077843680 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2_856_spg129
Cs2Te5 Cs2Te3
2025-04-15 03:22:06
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm077843680).
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 agm077843680
data_agm077843680
_cell_length_a 5.59293
_cell_length_b 5.88784
_cell_length_c 9.91988
_cell_angle_alpha 94.39080
_cell_angle_beta 118.55153
_cell_angle_gamma 91.49940
_cell_volume 285.36005
_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 0.29964 0.77580 0.78589 1.00000
Cs2 Cs 0.70036 0.22420 0.21411 1.00000
Te1 Te 0.52761 0.75914 0.46296 1.00000
Te2 Te 0.47239 0.24086 0.53704 1.00000
Te3 Te 0.14098 0.68742 0.14270 1.00000
Te4 Te 0.85902 0.31258 0.85730 1.00000
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