Fe2Pb
Alexandria ALEXAlex-ID: agm005423097 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2_2622_spg8
Pb Fe
2023-03-20 18:22:26.307013
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005423097).
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 agm005423097
data_agm005423097
_cell_length_a 5.77287
_cell_length_b 5.77287
_cell_length_c 6.67215
_cell_angle_alpha 66.63625
_cell_angle_beta 66.63625
_cell_angle_gamma 30.73698
_cell_volume 103.58935
_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
Fe1 Fe 0.87734 0.87734 0.53446 1.00000
Fe2 Fe 0.53736 0.53736 0.26743 1.00000
Fe3 Fe 0.46264 0.46264 0.73257 1.00000
Fe4 Fe 0.12266 0.12266 0.46554 1.00000
Pb1 Pb 0.16473 0.16473 0.85245 1.00000
Pb2 Pb 0.83527 0.83527 0.14755 1.00000
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