Li5(TbCd6)2
Alexandria ALEXAlex-ID: agm005677165 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_274_spg166
Li3Cd4 TbCd3 LiCd
2023-06-25 22:31:25.586023
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005677165).
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 agm005677165
data_agm005677165
_cell_length_a 7.44369
_cell_length_b 7.44369
_cell_length_c 7.44369
_cell_angle_alpha 82.46816
_cell_angle_beta 82.46816
_cell_angle_gamma 82.46815
_cell_volume 402.62588
_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 0.00000 0.00000 0.50000 1.00000
Li2 Li 0.00000 0.50000 0.00000 1.00000
Li3 Li 0.50000 0.00000 0.00000 1.00000
Li4 Li 0.90097 0.90097 0.90097 1.00000
Li5 Li 0.09903 0.09903 0.09903 1.00000
Tb1 Tb 0.65545 0.65545 0.65545 1.00000
Tb2 Tb 0.34455 0.34455 0.34455 1.00000
Cd1 Cd 0.29776 0.70224 1.00000 1.00000
Cd2 Cd 0.70224 0.00000 0.29776 1.00000
Cd3 Cd 0.00000 0.29776 0.70224 1.00000
Cd4 Cd 0.70224 0.29776 0.00000 1.00000
Cd5 Cd 0.29776 1.00000 0.70224 1.00000
Cd6 Cd 1.00000 0.70224 0.29776 1.00000
Cd7 Cd 0.34548 0.34548 0.85923 1.00000
Cd8 Cd 0.34548 0.85923 0.34548 1.00000
Cd9 Cd 0.85923 0.34548 0.34548 1.00000
Cd10 Cd 0.65452 0.14077 0.65452 1.00000
Cd11 Cd 0.65452 0.65452 0.14077 1.00000
Cd12 Cd 0.14077 0.65452 0.65452 1.00000
Get direct link