Hf2(CdPb)3
Alexandria ALEXAlex-ID: agm009707011 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3_1489_spg2
HfCd Pb Cd
2024-03-10 06:21:51.203612
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009707011).
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 agm009707011
data_agm009707011
_cell_length_a 10.56818
_cell_length_b 10.56818
_cell_length_c 5.93936
_cell_angle_alpha 83.60233
_cell_angle_beta 83.60233
_cell_angle_gamma 17.86685
_cell_volume 202.21951
_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
Hf1 Hf 0.74782 0.74782 0.21770 1.00000
Hf2 Hf 0.25218 0.25218 0.78230 1.00000
Cd1 Cd 0.12779 0.12779 0.13573 1.00000
Cd2 Cd 0.00000 0.00000 0.50000 1.00000
Cd3 Cd 0.87221 0.87221 0.86427 1.00000
Pb1 Pb 0.63415 0.63415 0.61975 1.00000
Pb2 Pb 0.36585 0.36585 0.38025 1.00000
Pb3 Pb 0.50000 0.50000 0.00000 1.00000
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