Tm6SbTe2As3
Alexandria ALEXAlex-ID: agm044359868 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_594_spg8
Tm6Sb5Te Tm3TeAs2 Tm2TeAs
2025-02-22 02:58:45
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm044359868).
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 agm044359868
data_agm044359868
_cell_length_a 7.21387
_cell_length_b 7.21387
_cell_length_c 7.32398
_cell_angle_alpha 80.59322
_cell_angle_beta 99.40678
_cell_angle_gamma 59.96455
_cell_volume 311.81181
_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 0.41986 0.90759 0.27656 1.00000
Tm2 Tm 0.23465 0.76535 0.72292 1.00000
Tm3 Tm 0.58014 0.09241 0.72344 1.00000
Tm4 Tm 0.09241 0.58014 0.27656 1.00000
Tm5 Tm 0.76535 0.23465 0.27708 1.00000
Tm6 Tm 0.90759 0.41986 0.72344 1.00000
Sb1 Sb 0.00000 0.00000 0.00000 1.00000
Te1 Te 0.33376 0.33376 0.00000 1.00000
Te2 Te 0.66624 0.66624 0.00000 1.00000
As1 As 0.16881 0.16881 0.50000 1.00000
As2 As 0.83119 0.83119 0.50000 1.00000
As3 As 0.50000 0.50000 0.50000 1.00000
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