LiCeGa
Alexandria ALEXAlex-ID: agm005649988 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_2574_spg44
CeGa Li4Ga Ce2Ga
2023-06-19 10:29:02.925744
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005649988).
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 agm005649988
data_agm005649988
_cell_length_a 4.54521
_cell_length_b 5.64057
_cell_length_c 5.64022
_cell_angle_alpha 89.10767
_cell_angle_beta 66.26161
_cell_angle_gamma 66.25642
_cell_volume 119.29659
_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 0.65369 0.20740 0.63802 1.00000
Li2 Li 0.65333 0.53388 0.31186 1.00000
Ce1 Ce 0.42498 0.09909 0.20338 1.00000
Ce2 Ce 0.19603 0.82846 0.93277 1.00000
Ga1 Ga 0.96772 0.72275 0.49472 1.00000
Ga2 Ga 0.96784 0.39047 0.82711 1.00000
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