Ta2Sn9Pb
Alexandria ALEXAlex-ID: agm101271981 · Space group: P6/mmm (#191)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C9_251_spg65
TaSn2 Sn Pb
2025-05-21 07:54:25
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm101271981).
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 agm101271981
data_agm101271981
_cell_length_a 9.48719
_cell_length_b 9.48719
_cell_length_c 4.02617
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.00000
_cell_volume 313.83266
_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
Ta1 Ta 0.33333 0.66667 0.00000 1.00000
Ta2 Ta 0.66667 0.33333 0.00000 1.00000
Sn1 Sn 0.19360 0.80640 0.50000 1.00000
Sn2 Sn 0.00000 0.50000 0.00000 1.00000
Sn3 Sn 0.50000 0.50000 0.00000 1.00000
Sn4 Sn 0.19360 0.38720 0.50000 1.00000
Sn5 Sn 0.80640 0.19360 0.50000 1.00000
Sn6 Sn 0.38720 0.19360 0.50000 1.00000
Sn7 Sn 0.80640 0.61280 0.50000 1.00000
Sn8 Sn 0.50000 0.00000 0.00000 1.00000
Sn9 Sn 0.61280 0.80640 0.50000 1.00000
Pb1 Pb 0.00000 0.00000 0.00000 1.00000
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