Li2Mg3Ga7
Alexandria ALEXAlex-ID: agm027014455 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C7_3_spg166
LiMg3Ga8 Li2Ga3 MgGa
2025-05-16 20:28:35
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm027014455).
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 agm027014455
data_agm027014455
_cell_length_a 8.95648
_cell_length_b 8.95648
_cell_length_c 8.95648
_cell_angle_alpha 36.50074
_cell_angle_beta 36.50074
_cell_angle_gamma 36.50074
_cell_volume 227.57869
_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 0.33477 0.33477 0.33477 1.00000
Li2 Li 0.66523 0.66523 0.66523 1.00000
Mg1 Mg 0.00000 0.00000 0.00000 1.00000
Mg2 Mg 0.14129 0.14129 0.14129 1.00000
Mg3 Mg 0.85871 0.85871 0.85871 1.00000
Ga1 Ga 0.50000 0.50000 0.50000 1.00000
Ga2 Ga 0.07412 0.58923 0.58923 1.00000
Ga3 Ga 0.58923 0.58923 0.07412 1.00000
Ga4 Ga 0.58923 0.07412 0.58923 1.00000
Ga5 Ga 0.92588 0.41077 0.41077 1.00000
Ga6 Ga 0.41077 0.92588 0.41077 1.00000
Ga7 Ga 0.41077 0.41077 0.92588 1.00000
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