Sm3(SiPt)4
Alexandria ALEXAlex-ID: agm009918239 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_136_spg12
SmSiPt Sm(SiPt)2
2024-04-19 20:56:52.551864
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009918239).
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 agm009918239
data_agm009918239
_cell_length_a 12.75638
_cell_length_b 12.75638
_cell_length_c 12.75638
_cell_angle_alpha 161.28298
_cell_angle_beta 161.03095
_cell_angle_gamma 26.77159
_cell_volume 216.44135
_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 0.64885 0.14885 0.50000 1.00000
Sm2 Sm 0.35115 0.85115 0.50000 1.00000
Sm3 Sm 0.00000 0.00000 0.00000 1.00000
Si1 Si 0.74936 0.74936 0.00000 1.00000
Si2 Si 0.89907 0.39907 0.50000 1.00000
Si3 Si 0.10093 0.60093 0.50000 1.00000
Si4 Si 0.25064 0.25064 0.00000 1.00000
Pt1 Pt 0.19924 0.69924 0.50000 1.00000
Pt2 Pt 0.55481 0.55481 0.00000 1.00000
Pt3 Pt 0.44519 0.44519 0.00000 1.00000
Pt4 Pt 0.80076 0.30076 0.50000 1.00000
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