Er4TlTe2
Alexandria ALEXAlex-ID: agm003454161 · Space group: I4_122 (#98)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_1160_spg98
Er4TlTe3 Er10(TlTe)3 ErTe
2022-03-01 04:15:19.841320
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003454161).
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 agm003454161
data_agm003454161
_cell_length_a 8.18064
_cell_length_b 8.18086
_cell_length_c 8.18283
_cell_angle_alpha 108.90696
_cell_angle_beta 108.92042
_cell_angle_gamma 110.59593
_cell_volume 421.42653
_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
Er1 Er 0.90170 0.24910 0.26700 1.00000
Er2 Er 0.26796 0.50111 0.15269 1.00000
Er3 Er 0.98197 0.63454 0.73321 1.00000
Er4 Er 0.75089 0.09835 0.73292 1.00000
Er5 Er 0.36542 0.01794 0.26673 1.00000
Er6 Er 0.34833 0.11525 0.84756 1.00000
Er7 Er 0.49914 0.73213 0.84744 1.00000
Er8 Er 0.88467 0.65157 0.15243 1.00000
Tl1 Tl 0.25011 0.75003 0.50005 1.00000
Tl2 Tl 0.99983 0.99990 0.99992 1.00000
Te1 Te 0.58363 0.37478 0.70880 1.00000
Te2 Te 0.66615 0.87507 0.29102 1.00000
Te3 Te 0.62512 0.41621 0.29109 1.00000
Te4 Te 0.12508 0.33403 0.70913 1.00000
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