Pm4BiPb2
Alexandria ALEXAlex-ID: agm003444580 · Space group: I-42d (#122)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_39_spg122
Pm5(BiPb)2 Pm4Pb3 Pm5Pb3
2022-02-18 20:02:46.402463
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003444580).
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 agm003444580
data_agm003444580
_cell_length_a 8.34631
_cell_length_b 8.34627
_cell_length_c 8.34649
_cell_angle_alpha 109.37890
_cell_angle_beta 109.38137
_cell_angle_gamma 109.65243
_cell_volume 447.58076
_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
Pm1 Pm 0.87270 0.26503 0.24959 1.00000
Pm2 Pm 0.23429 0.48492 0.10737 1.00000
Pm3 Pm 0.01546 0.62313 0.75043 1.00000
Pm4 Pm 0.73494 0.98428 0.60737 1.00000
Pm5 Pm 0.37690 0.12757 0.39261 1.00000
Pm6 Pm 0.37755 0.12691 0.89261 1.00000
Pm7 Pm 0.51503 0.62269 0.74957 1.00000
Pm8 Pm 0.87314 0.76548 0.25045 1.00000
Bi1 Bi 0.25006 0.75005 0.50000 1.00000
Bi2 Bi 0.99996 0.99997 1.00000 1.00000
Pb1 Pb 0.75150 0.37490 0.87641 1.00000
Pb2 Pb 0.49848 0.87509 0.12359 1.00000
Pb3 Pb 0.62490 0.50145 0.37635 1.00000
Pb4 Pb 0.12509 0.24853 0.62364 1.00000
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