Tl8Pb4Au
Alexandria ALEXAlex-ID: agm097629677 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1732_spg8
TlPb Pb2Au Tl
2025-06-02 11:12:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097629677).
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 agm097629677
data_agm097629677
_cell_length_a 5.28247
_cell_length_b 9.42989
_cell_length_c 9.47794
_cell_angle_alpha 119.83349
_cell_angle_beta 81.75638
_cell_angle_gamma 90.00297
_cell_volume 403.92625
_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 0.39890 0.20755 0.41512 1.00000
Tl2 Tl 0.31477 0.14552 0.73761 1.00000
Tl3 Tl 0.44416 0.71660 0.43322 1.00000
Tl4 Tl 0.31476 0.59211 0.73756 1.00000
Tl5 Tl 0.52903 0.31599 0.10248 1.00000
Tl6 Tl 0.80190 0.37649 0.75296 1.00000
Tl7 Tl 0.52903 0.78645 0.10245 1.00000
Tl8 Tl 0.91193 0.85942 0.71880 1.00000
Pb1 Pb 0.95081 0.06950 0.13904 1.00000
Pb2 Pb 0.92335 0.95736 0.41743 1.00000
Pb3 Pb 0.04374 0.55936 0.11875 1.00000
Pb4 Pb 0.92336 0.46006 0.41741 1.00000
Au1 Au 0.41425 0.95359 0.90718 1.00000
Get direct link