La4Ge(TeCl)2
Alexandria ALEXAlex-ID: agm004557442 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D4_211_spg12
La3GeCl3 La6GeTe5 LaCl3 La3GeTe2
2022-06-19 12:02:50.276770
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004557442).
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 agm004557442
data_agm004557442
_cell_length_a 4.39708
_cell_length_b 8.77313
_cell_length_c 8.27316
_cell_angle_alpha 115.89537
_cell_angle_beta 90.00000
_cell_angle_gamma 104.51299
_cell_volume 275.73733
_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
La1 La 0.79481 0.58962 0.76997 1.00000
La2 La 0.20519 0.41038 0.23003 1.00000
La3 La 0.49933 0.99867 0.25165 1.00000
La4 La 0.50067 0.00133 0.74835 1.00000
Ge1 Ge 0.00000 0.00000 0.00000 1.00000
Te1 Te 0.86444 0.72889 0.45219 1.00000
Te2 Te 0.13556 0.27111 0.54781 1.00000
Cl1 Cl 0.31914 0.63828 0.02419 1.00000
Cl2 Cl 0.68086 0.36172 0.97581 1.00000
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