LiCd2Hg5Pb
Alexandria ALEXAlex-ID: agm005154875 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D5_208_spg71
LiCd3 Li3CdHg4 Pb Hg
2023-01-08 09:05:18.187991
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005154875).
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 agm005154875
data_agm005154875
_cell_length_a 5.06445
_cell_length_b 6.26823
_cell_length_c 8.68955
_cell_angle_alpha 111.14175
_cell_angle_beta 106.94241
_cell_angle_gamma 90.00000
_cell_volume 244.40320
_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
Cd1 Cd 0.19239 0.19239 0.38479 1.00000
Cd2 Cd 0.80761 0.80761 0.61521 1.00000
Hg1 Hg 0.63799 0.87365 0.27598 1.00000
Hg2 Hg 0.36201 0.12635 0.72402 1.00000
Hg3 Hg 0.36201 0.59767 0.72402 1.00000
Hg4 Hg 0.63799 0.40233 0.27598 1.00000
Hg5 Hg 0.00000 0.00000 0.00000 1.00000
Pb1 Pb 0.00000 0.50000 0.00000 1.00000
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