Li2Ga2Pd
Alexandria ALEXAlex-ID: agm014136371 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_2_spg71
Li2Ga2Pd
2025-02-07 08:38:44
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm014136371).
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 agm014136371
data_agm014136371
_cell_length_a 4.30748
_cell_length_b 4.30748
_cell_length_c 5.17022
_cell_angle_alpha 65.18443
_cell_angle_beta 114.81557
_cell_angle_gamma 119.93564
_cell_volume 72.70989
_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 0.69890 0.30110 0.09693 1.00000
Li2 Li 0.30110 0.69890 0.90307 1.00000
Ga1 Ga 0.89756 0.10244 0.69340 1.00000
Ga2 Ga 0.10244 0.89756 0.30660 1.00000
Pd1 Pd 0.50000 0.50000 0.50000 1.00000
