U(Te2Br3)2
Alexandria ALEXAlex-ID: agm002201772 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C6_16_spg2
Te2Br UBr5 Te
2018-10-15 12:46:02
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002201772).
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 agm002201772
data_agm002201772
_cell_length_a 8.27207
_cell_length_b 8.41689
_cell_length_c 7.21793
_cell_angle_alpha 77.60245
_cell_angle_beta 78.44769
_cell_angle_gamma 79.32406
_cell_volume 475.54288
_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
Te1 Te 0.41858 0.43223 0.29759 1.00000
Te2 Te 0.58142 0.56777 0.70241 1.00000
Te3 Te 0.68302 0.31855 0.49338 1.00000
Te4 Te 0.31698 0.68145 0.50662 1.00000
U1 U 0.00000 0.00000 0.00000 1.00000
Br1 Br 0.96235 0.31002 0.77599 1.00000
Br2 Br 0.03765 0.68998 0.22401 1.00000
Br3 Br 0.12217 0.12294 0.24948 1.00000
Br4 Br 0.87783 0.87706 0.75052 1.00000
Br5 Br 0.68000 0.06373 0.19666 1.00000
Br6 Br 0.32000 0.93627 0.80334 1.00000
Get direct link