Li2(AcGe)5
Alexandria ALEXAlex-ID: agm005665181 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_19_spg12
Li2Ac2Ge3 LiAcGe Ac4Ge3
2023-06-19 02:42:31.638371
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005665181).
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 agm005665181
data_agm005665181
_cell_length_a 4.52579
_cell_length_b 8.45714
_cell_length_c 9.47083
_cell_angle_alpha 86.80601
_cell_angle_beta 76.17645
_cell_angle_gamma 74.48014
_cell_volume 339.15090
_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 0.39181 0.46186 0.75453 1.00000
Li2 Li 0.60819 0.53814 0.24547 1.00000
Ac1 Ac 0.00000 0.50000 0.50000 1.00000
Ac2 Ac 0.68545 0.71321 0.91590 1.00000
Ac3 Ac 0.37262 0.94025 0.31451 1.00000
Ac4 Ac 0.62738 0.05975 0.68549 1.00000
Ac5 Ac 0.31455 0.28679 0.08410 1.00000
Ge1 Ge 0.69043 0.24147 0.37767 1.00000
Ge2 Ge 0.92468 0.31820 0.83244 1.00000
Ge3 Ge 0.07532 0.68180 0.16756 1.00000
Ge4 Ge 0.30957 0.75853 0.62233 1.00000
Ge5 Ge 0.00000 0.00000 0.00000 1.00000
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