Tl5Pb3
Alexandria ALEXAlex-ID: agm009409593 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B5_39_spg71
TlPb Tl
2024-05-28 01:47:58.527186
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009409593).
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 agm009409593
data_agm009409593
_cell_length_a 10.44192
_cell_length_b 10.44192
_cell_length_c 10.44192
_cell_angle_alpha 153.17221
_cell_angle_beta 150.99072
_cell_angle_gamma 39.92295
_cell_volume 248.70635
_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
Tl1 Tl 0.24848 0.74848 0.50000 1.00000
Tl2 Tl 0.75152 0.25152 0.50000 1.00000
Tl3 Tl 0.87603 0.87603 0.00000 1.00000
Tl4 Tl 0.00000 0.50000 0.50000 1.00000
Tl5 Tl 0.12397 0.12397 0.00000 1.00000
Pb1 Pb 0.37568 0.37568 0.00000 1.00000
Pb2 Pb 0.62432 0.62432 0.00000 1.00000
Pb3 Pb 0.50000 0.00000 0.50000 1.00000
Get direct link