Tm12Tl5Te2
Alexandria ALEXAlex-ID: agm003370276 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C12_97_spg12
Tm5Tl3 Tm10(TlTe)3 Tm
2022-02-08 11:50:05.210182
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003370276).
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 agm003370276
data_agm003370276
_cell_length_a 8.37986
_cell_length_b 9.11208
_cell_length_c 8.53282
_cell_angle_alpha 103.13741
_cell_angle_beta 90.00000
_cell_angle_gamma 117.37558
_cell_volume 559.30991
_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
Tm1 Tm 0.88399 0.76798 0.15691 1.00000
Tm2 Tm 0.10342 0.63000 0.81078 1.00000
Tm3 Tm 0.52658 0.63000 0.81078 1.00000
Tm4 Tm 0.18246 0.76607 0.45427 1.00000
Tm5 Tm 0.58361 0.76607 0.45427 1.00000
Tm6 Tm 0.50869 0.01738 0.79236 1.00000
Tm7 Tm 0.49131 0.98262 0.20764 1.00000
Tm8 Tm 0.81754 0.23393 0.54573 1.00000
Tm9 Tm 0.41639 0.23393 0.54573 1.00000
Tm10 Tm 0.89658 0.37000 0.18922 1.00000
Tm11 Tm 0.47342 0.37000 0.18922 1.00000
Tm12 Tm 0.11601 0.23202 0.84309 1.00000
Tl1 Tl 0.21226 0.42452 0.48263 1.00000
Tl2 Tl 0.29509 0.59018 0.11195 1.00000
Tl3 Tl 0.00000 0.00000 0.50000 1.00000
Tl4 Tl 0.70491 0.40982 0.88805 1.00000
Tl5 Tl 0.78774 0.57548 0.51737 1.00000
Te1 Te 0.78852 1.00000 0.00000 1.00000
Te2 Te 0.21148 0.00000 0.00000 1.00000
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