Sm6Sb3Te
Alexandria ALEXAlex-ID: agm003576014 · Space group: Cmc2_1 (#36)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C6_290_spg36
Sm5Sb3 SmTe
2022-04-01 07:53:18.366167
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003576014).
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 agm003576014
data_agm003576014
_cell_length_a 7.68630
_cell_length_b 9.47133
_cell_length_c 9.47133
_cell_angle_alpha 103.79858
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 669.60808
_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
Sm1 Sm 0.16265 0.71398 0.62271 1.00000
Sm2 Sm 0.66265 0.62271 0.71398 1.00000
Sm3 Sm 0.22891 0.44957 0.91002 1.00000
Sm4 Sm 0.72891 0.91002 0.44957 1.00000
Sm5 Sm 0.25131 0.00528 0.99472 1.00000
Sm6 Sm 0.62743 0.24830 0.75170 1.00000
Sm7 Sm 0.12743 0.75170 0.24830 1.00000
Sm8 Sm 0.75131 0.99472 0.00528 1.00000
Sm9 Sm 0.22891 0.08998 0.55043 1.00000
Sm10 Sm 0.72891 0.55043 0.08998 1.00000
Sm11 Sm 0.16265 0.37729 0.28602 1.00000
Sm12 Sm 0.66265 0.28602 0.37729 1.00000
Sb1 Sb 0.48782 0.92073 0.71901 1.00000
Sb2 Sb 0.98782 0.71901 0.92073 1.00000
Sb3 Sb 0.35270 0.41205 0.58795 1.00000
Sb4 Sb 0.85270 0.58795 0.41205 1.00000
Sb5 Sb 0.98782 0.07927 0.28099 1.00000
Sb6 Sb 0.48782 0.28099 0.07927 1.00000
Te1 Te 0.99514 0.16773 0.83227 1.00000
Te2 Te 0.49514 0.83227 0.16773 1.00000
