Sm5TmSb5
Alexandria ALEXAlex-ID: agm003674053 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C5_0_spg12
Sm3Tm2Sb3 SmSb
2022-04-09 16:29:49.741836
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003674053).
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 agm003674053
data_agm003674053
_cell_length_a 6.24339
_cell_length_b 7.62852
_cell_length_c 8.80277
_cell_angle_alpha 106.95832
_cell_angle_beta 90.00000
_cell_angle_gamma 114.15545
_cell_volume 362.47411
_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 0.67002 0.34003 0.33317 1.00000
Sm2 Sm 0.66424 0.32847 0.83039 1.00000
Sm3 Sm 0.00000 0.00000 0.50000 1.00000
Sm4 Sm 0.33576 0.67153 0.16961 1.00000
Sm5 Sm 0.32998 0.65997 0.66683 1.00000
Tm1 Tm 0.00000 0.00000 0.00000 1.00000
Sb1 Sb 0.83437 0.66873 0.16390 1.00000
Sb2 Sb 0.83555 0.67110 0.66978 1.00000
Sb3 Sb 0.50000 0.00000 0.00000 1.00000
Sb4 Sb 0.16445 0.32890 0.33022 1.00000
Sb5 Sb 0.16563 0.33127 0.83610 1.00000
Get direct link