Li4Ac3Zn2
Alexandria ALEXAlex-ID: agm005674906 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_134_spg12
Ac4Zn AcZn Li
2023-06-27 09:48:19.142359
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005674906).
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 agm005674906
data_agm005674906
_cell_length_a 4.94922
_cell_length_b 6.19285
_cell_length_c 9.21190
_cell_angle_alpha 70.97487
_cell_angle_beta 74.41651
_cell_angle_gamma 66.44843
_cell_volume 241.54634
_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 0.28835 0.37896 0.04436 1.00000
Li2 Li 0.89144 0.55425 0.66282 1.00000
Li3 Li 0.10856 0.44575 0.33718 1.00000
Li4 Li 0.71165 0.62104 0.95564 1.00000
Ac1 Ac 0.60203 0.15854 0.63738 1.00000
Ac2 Ac 0.00000 0.00000 0.00000 1.00000
Ac3 Ac 0.39797 0.84146 0.36262 1.00000
Zn1 Zn 0.71522 0.31760 0.25200 1.00000
Zn2 Zn 0.28478 0.68240 0.74800 1.00000
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