Sc3Te
Alexandria ALEXAlex-ID: agm005493010 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3_6_spg139
Sc9Te2 Sc2Te
2023-03-19 03:53:37.717906
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005493010).
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 agm005493010
data_agm005493010
_cell_length_a 10.11711
_cell_length_b 10.11711
_cell_length_c 10.11711
_cell_angle_alpha 155.13887
_cell_angle_beta 155.13887
_cell_angle_gamma 35.44635
_cell_volume 182.82007
_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
Sc1 Sc 0.00000 0.50000 0.50000 1.00000
Sc2 Sc 0.50000 0.00000 0.50000 1.00000
Sc3 Sc 0.75000 0.25000 0.50000 1.00000
Sc4 Sc 0.25000 0.75000 0.50000 1.00000
Sc5 Sc 0.87529 0.87529 0.00000 1.00000
Sc6 Sc 0.12471 0.12471 0.00000 1.00000
Te1 Te 0.62000 0.62000 0.00000 1.00000
Te2 Te 0.38000 0.38000 0.00000 1.00000
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