Bi2Pt3Pb2
Alexandria ALEXAlex-ID: agm003304581 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_272_spg12
BiPt2Pb3 BiPt3Pb2 Bi2Pt
2022-02-03 21:05:47.544728
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003304581).
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 agm003304581
data_agm003304581
_cell_length_a 3.90628
_cell_length_b 7.32975
_cell_length_c 6.32600
_cell_angle_alpha 90.28406
_cell_angle_beta 89.96692
_cell_angle_gamma 105.24204
_cell_volume 174.75296
_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
Bi1 Bi 0.64495 0.29374 0.92071 1.00000
Bi2 Bi 0.35505 0.70626 0.07929 1.00000
Pt1 Pt 0.00000 0.00000 0.00000 1.00000
Pt2 Pt 0.74636 0.48524 0.32239 1.00000
Pt3 Pt 0.25364 0.51476 0.67761 1.00000
Pb1 Pb 0.89343 0.79778 0.61437 1.00000
Pb2 Pb 0.10657 0.20222 0.38563 1.00000
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