Li7MgIn4
Alexandria ALEXAlex-ID: agm003667599 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_86_spg12
Li2In Li2MgIn Li3In2
2022-04-27 03:19:35.792615
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003667599).
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 agm003667599
data_agm003667599
_cell_length_a 4.96040
_cell_length_b 7.73931
_cell_length_c 7.49468
_cell_angle_alpha 67.74054
_cell_angle_beta 70.67489
_cell_angle_gamma 71.30879
_cell_volume 244.92479
_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 0.78875 0.87815 0.54434 1.00000
Li2 Li 0.21125 0.12185 0.45566 1.00000
Li3 Li 0.07864 0.56628 0.27643 1.00000
Li4 Li 0.92136 0.43372 0.72357 1.00000
Li5 Li 0.25345 0.72752 0.76557 1.00000
Li6 Li 0.50000 0.00000 0.00000 1.00000
Li7 Li 0.74655 0.27248 0.23443 1.00000
Mg1 Mg 0.00000 0.00000 0.00000 1.00000
In1 In 0.55500 0.27351 0.61650 1.00000
In2 In 0.44500 0.72649 0.38350 1.00000
In3 In 0.68236 0.65069 0.98460 1.00000
In4 In 0.31764 0.34931 0.01540 1.00000
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