Ni2SbTe3
Alexandria ALEXAlex-ID: agm005698140 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_26_spg164
Ni2SbTe2 Sb2Te3 NiTe2
2023-08-23 07:10:36.680781
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005698140).
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 agm005698140
data_agm005698140
_cell_length_a 7.74893
_cell_length_b 7.74876
_cell_length_c 5.24651
_cell_angle_alpha 88.64230
_cell_angle_beta 88.64530
_cell_angle_gamma 60.04089
_cell_volume 272.82977
_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
Ni1 Ni 0.00000 0.00000 0.00000 1.00000
Ni2 Ni 0.50000 0.00000 0.00000 1.00000
Ni3 Ni 0.50000 0.50000 0.00000 1.00000
Ni4 Ni 0.00000 0.50000 0.00000 1.00000
Sb1 Sb 0.33021 0.33019 0.25942 1.00000
Sb2 Sb 0.66979 0.66981 0.74058 1.00000
Te1 Te 0.17260 0.66196 0.75550 1.00000
Te2 Te 0.66194 0.17262 0.75551 1.00000
Te3 Te 0.17341 0.17343 0.75493 1.00000
Te4 Te 0.33806 0.82738 0.24449 1.00000
Te5 Te 0.82740 0.33804 0.24450 1.00000
Te6 Te 0.82659 0.82657 0.24507 1.00000
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