Cd(PbCl2)4
Alexandria ALEXAlex-ID: agm097484338 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_540_spg12
PbCl2 Cd
2025-06-12 20:16:10
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097484338).
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 agm097484338
data_agm097484338
_cell_length_a 7.16967
_cell_length_b 8.84826
_cell_length_c 8.84824
_cell_angle_alpha 120.29209
_cell_angle_beta 90.38758
_cell_angle_gamma 89.61530
_cell_volume 484.66905
_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
Cd1 Cd 0.44692 0.99691 0.00306 1.00000
Pb1 Pb 0.86084 0.00082 0.99918 1.00000
Pb2 Pb 0.03929 0.49991 0.00310 1.00000
Pb3 Pb 0.02326 0.50292 0.49706 1.00000
Pb4 Pb 0.03938 0.99692 0.50009 1.00000
Cl1 Cl 0.80613 0.81271 0.18736 1.00000
Cl2 Cl 0.79541 0.37489 0.17673 1.00000
Cl3 Cl 0.82831 0.32880 0.67113 1.00000
Cl4 Cl 0.79546 0.82329 0.62510 1.00000
Cl5 Cl 0.20338 0.16098 0.31118 1.00000
Cl6 Cl 0.24602 0.65944 0.34050 1.00000
Cl7 Cl 0.20333 0.68881 0.83904 1.00000
Cl8 Cl 0.21228 0.15360 0.84648 1.00000
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