Li2La3
Alexandria ALEXAlex-ID: agm005407885 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3_74_spg166
La Li
2023-03-19 11:30:32.998539
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005407885).
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 agm005407885
data_agm005407885
_cell_length_a 14.24248
_cell_length_b 14.24248
_cell_length_c 14.24248
_cell_angle_alpha 14.64276
_cell_angle_beta 14.64276
_cell_angle_gamma 14.64276
_cell_volume 160.75688
_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 0.39856 0.39856 0.39856 1.00000
Li2 Li 0.60144 0.60144 0.60144 1.00000
La1 La 0.00000 0.00000 0.00000 1.00000
La2 La 0.79832 0.79832 0.79832 1.00000
La3 La 0.20168 0.20168 0.20168 1.00000
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