Na5Sn2Pb5
Alexandria ALEXAlex-ID: agm005644974 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_72_spg12
NaPb3 NaSn NaPb
2023-06-20 17:13:41.564271
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005644974).
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 agm005644974
data_agm005644974
_cell_length_a 5.25704
_cell_length_b 6.09523
_cell_length_c 13.40311
_cell_angle_alpha 101.79349
_cell_angle_beta 78.81509
_cell_angle_gamma 64.55519
_cell_volume 359.82172
_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
Na1 Na 0.50000 0.50000 0.50000 1.00000
Na2 Na 0.35664 0.30634 0.98212 1.00000
Na3 Na 0.25826 0.16838 0.30035 1.00000
Na4 Na 0.74174 0.83162 0.69965 1.00000
Na5 Na 0.64336 0.69366 0.01788 1.00000
Sn1 Sn 0.01133 0.20268 0.79513 1.00000
Sn2 Sn 0.98867 0.79732 0.20487 1.00000
Pb1 Pb 0.86590 0.82654 0.44118 1.00000
Pb2 Pb 0.36337 0.52249 0.76869 1.00000
Pb3 Pb 0.63663 0.47751 0.23131 1.00000
Pb4 Pb 0.13410 0.17345 0.55882 1.00000
Pb5 Pb 0.00000 0.00000 0.00000 1.00000
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