LiSi(AgTe2)2
Alexandria ALEXAlex-ID: agm004786089 · Space group: I-42m (#121)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_36_spg42
LiTe3 SiAg2Te3 Li2Te
2022-07-17 01:13:11.080401
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004786089).
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 agm004786089
data_agm004786089
_cell_length_a 6.29991
_cell_length_b 6.29991
_cell_length_c 7.67653
_cell_angle_alpha 114.20148
_cell_angle_beta 114.20148
_cell_angle_gamma 90.05433
_cell_volume 248.18539
_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
Li1 Li 0.00016 0.00016 0.00032 1.00000
Si1 Si 0.49998 0.49998 0.99996 1.00000
Ag1 Ag 0.75012 0.25012 0.50024 1.00000
Ag2 Ag 0.25012 0.75012 0.50024 1.00000
Te1 Te 0.61700 0.61700 0.76566 1.00000
Te2 Te 0.38315 0.85110 0.23425 1.00000
Te3 Te 0.85110 0.38315 0.23425 1.00000
Te4 Te 0.14866 0.14866 0.76566 1.00000
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