Li(Ac4In)2
Alexandria ALEXAlex-ID: agm003532007 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_277_spg12
Ac5In3 LiAcIn Ac
2022-04-24 20:22:16.320088
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003532007).
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 agm003532007
data_agm003532007
_cell_length_a 5.73056
_cell_length_b 7.68680
_cell_length_c 10.41729
_cell_angle_alpha 100.57404
_cell_angle_beta 105.96502
_cell_angle_gamma 90.00000
_cell_volume 433.06857
_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 0.50000 0.00000 0.00000 1.00000
Ac1 Ac 0.40606 0.53742 0.81211 1.00000
Ac2 Ac 0.65835 0.95728 0.31671 1.00000
Ac3 Ac 0.80298 0.70772 0.60596 1.00000
Ac4 Ac 0.97599 0.24308 0.95198 1.00000
Ac5 Ac 0.19702 0.29228 0.39404 1.00000
Ac6 Ac 0.34165 0.04272 0.68329 1.00000
Ac7 Ac 0.59394 0.46258 0.18789 1.00000
Ac8 Ac 0.02401 0.75692 0.04802 1.00000
In1 In 0.80471 0.26356 0.60942 1.00000
In2 In 0.19529 0.73644 0.39058 1.00000
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