Li2In3Ag5
Alexandria ALEXAlex-ID: agm005605789 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5_98_spg15
In2Ag5 LiInAg2 In
2023-06-24 18:52:57.039724
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005605789).
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 agm005605789
data_agm005605789
_cell_length_a 5.70525
_cell_length_b 8.50213
_cell_length_c 8.50222
_cell_angle_alpha 107.63993
_cell_angle_beta 92.05455
_cell_angle_gamma 92.05512
_cell_volume 392.29783
_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 0.88380 0.61955 0.13109 1.00000
Li2 Li 0.38382 0.13110 0.61956 1.00000
Li3 Li 0.11620 0.38045 0.86891 1.00000
Li4 Li 0.61618 0.86890 0.38044 1.00000
In1 In 0.61483 0.48321 0.78395 1.00000
In2 In 0.11483 0.78395 0.48321 1.00000
In3 In 0.38517 0.51679 0.21605 1.00000
In4 In 0.88517 0.21605 0.51679 1.00000
In5 In 0.25000 0.05394 0.94606 1.00000
In6 In 0.75000 0.94606 0.05394 1.00000
Ag1 Ag 0.64464 0.27396 0.97340 1.00000
Ag2 Ag 0.14463 0.97339 0.27395 1.00000
Ag3 Ag 0.35536 0.72604 0.02660 1.00000
Ag4 Ag 0.85537 0.02661 0.72605 1.00000
Ag5 Ag 0.99419 0.70758 0.78830 1.00000
Ag6 Ag 0.00581 0.29242 0.21170 1.00000
Ag7 Ag 0.75000 0.54270 0.45730 1.00000
Ag8 Ag 0.25000 0.45730 0.54270 1.00000
Ag9 Ag 0.50582 0.21169 0.29242 1.00000
Ag10 Ag 0.49418 0.78831 0.70758 1.00000
