Sr6Tl2Au
Alexandria ALEXAlex-ID: agm097427240 · Space group: P4/mmm (#123)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_6276_spg12
Sr2Tl Sr8Tl3 Sr5TlAu2
2025-04-07 06:20:08
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097427240).
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 agm097427240
data_agm097427240
_cell_length_a 5.95958
_cell_length_b 5.95958
_cell_length_c 10.96469
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 389.42861
_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
Sr1 Sr 0.50000 0.50000 0.72807 1.00000
Sr2 Sr 0.50000 0.50000 0.27193 1.00000
Sr3 Sr 0.00000 0.50000 0.00000 1.00000
Sr4 Sr 0.00000 0.50000 0.50000 1.00000
Sr5 Sr 0.50000 0.00000 0.00000 1.00000
Sr6 Sr 0.50000 0.00000 0.50000 1.00000
Tl1 Tl 0.00000 0.00000 0.71448 1.00000
Tl2 Tl 0.00000 0.00000 0.28552 1.00000
Au1 Au 0.50000 0.50000 0.00000 1.00000
Get direct link