Li2Ac3Cd4
Alexandria ALEXAlex-ID: agm005602897 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_664_spg12
Li2Cd AcCd
2023-06-27 08:37:13.484261
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005602897).
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 agm005602897
data_agm005602897
_cell_length_a 5.17487
_cell_length_b 6.41468
_cell_length_c 9.15640
_cell_angle_alpha 75.58313
_cell_angle_beta 73.58563
_cell_angle_gamma 66.21148
_cell_volume 263.61527
_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 0.38235 0.95032 0.28499 1.00000
Li2 Li 0.61765 0.04968 0.71501 1.00000
Ac1 Ac 0.33586 0.65902 0.66925 1.00000
Ac2 Ac 0.00000 0.00000 0.00000 1.00000
Ac3 Ac 0.66414 0.34098 0.33075 1.00000
Cd1 Cd 0.27875 0.38021 0.06228 1.00000
Cd2 Cd 0.72125 0.61979 0.93772 1.00000
Cd3 Cd 0.06080 0.26656 0.61185 1.00000
Cd4 Cd 0.93920 0.73344 0.38815 1.00000
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