Li2La2Ga2H
Alexandria ALEXAlex-ID: agm007496587 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_204_spg139
LiLaGa2 LaGa Li LaH2
2024-03-16 09:52:39.532882
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007496587).
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 agm007496587
data_agm007496587
_cell_length_a 7.63931
_cell_length_b 7.63931
_cell_length_c 7.63931
_cell_angle_alpha 145.24068
_cell_angle_beta 145.24068
_cell_angle_gamma 49.97600
_cell_volume 144.21713
_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 0.00000 0.50000 0.50000 1.00000
Li2 Li 0.50000 0.00000 0.50000 1.00000
La1 La 0.17355 0.17355 0.00000 1.00000
La2 La 0.82645 0.82645 0.00000 1.00000
Ga1 Ga 0.39761 0.39761 0.00000 1.00000
Ga2 Ga 0.60239 0.60239 0.00000 1.00000
H1 H 0.00000 0.00000 0.00000 1.00000
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