Ac5Tl5In2
Alexandria ALEXAlex-ID: agm005667264 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_18_spg12
Ac3Tl5 Ac3In5 AcTl
2023-06-19 01:24:45.359259
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005667264).
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 agm005667264
data_agm005667264
_cell_length_a 5.14679
_cell_length_b 9.22068
_cell_length_c 9.48576
_cell_angle_alpha 95.27773
_cell_angle_beta 74.25893
_cell_angle_gamma 73.79412
_cell_volume 409.16063
_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
Ac1 Ac 0.00000 0.50000 0.50000 1.00000
Ac2 Ac 0.67853 0.71785 0.92510 1.00000
Ac3 Ac 0.35633 0.95810 0.32923 1.00000
Ac4 Ac 0.64367 0.04190 0.67077 1.00000
Ac5 Ac 0.32147 0.28215 0.07490 1.00000
Tl1 Tl 0.70347 0.23092 0.36215 1.00000
Tl2 Tl 0.94833 0.29378 0.80956 1.00000
Tl3 Tl 0.05167 0.70622 0.19044 1.00000
Tl4 Tl 0.29653 0.76908 0.63785 1.00000
Tl5 Tl 0.00000 0.00000 0.00000 1.00000
In1 In 0.37629 0.47538 0.77204 1.00000
In2 In 0.62371 0.52462 0.22796 1.00000
Get direct link