Sm2SbPt6
Alexandria ALEXAlex-ID: agm005751981 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_724_spg12
SmSbPt Sm8SbPt24 Sb2Pt
2023-07-09 08:07:10.556008
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005751981).
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 agm005751981
data_agm005751981
_cell_length_a 5.75270
_cell_length_b 5.72283
_cell_length_c 6.40344
_cell_angle_alpha 78.67600
_cell_angle_beta 90.00000
_cell_angle_gamma 120.17281
_cell_volume 177.48684
_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 0.64232 0.28463 0.15283 1.00000
Sm2 Sm 0.35768 0.71537 0.84717 1.00000
Sb1 Sb 0.00000 0.00000 0.00000 1.00000
Pt1 Pt 0.87487 0.27282 0.68061 1.00000
Pt2 Pt 0.87493 0.74986 0.68536 1.00000
Pt3 Pt 0.39795 0.27282 0.68061 1.00000
Pt4 Pt 0.12513 0.72718 0.31939 1.00000
Pt5 Pt 0.12507 0.25014 0.31464 1.00000
Pt6 Pt 0.60205 0.72718 0.31939 1.00000
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