Sn5Pt3
Alexandria ALEXAlex-ID: agm007884584 · Space group: I4/mcm (#140)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B5_0_spg140
Sn3Pt2 Sn2Pt
2024-03-08 02:40:20.855637
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007884584).
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 agm007884584
data_agm007884584
_cell_length_a 8.05877
_cell_length_b 8.05877
_cell_length_c 8.05877
_cell_angle_alpha 100.84782
_cell_angle_beta 100.84782
_cell_angle_gamma 128.57934
_cell_volume 368.63481
_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
Sn1 Sn 0.75000 0.25000 0.50000 1.00000
Sn2 Sn 0.25000 0.75000 0.50000 1.00000
Sn3 Sn 0.70252 0.42019 0.12270 1.00000
Sn4 Sn 0.29748 0.57981 0.87730 1.00000
Sn5 Sn 0.79748 0.92019 0.71767 1.00000
Sn6 Sn 0.20252 0.07981 0.28233 1.00000
Sn7 Sn 0.92019 0.20252 0.12270 1.00000
Sn8 Sn 0.07981 0.79748 0.87730 1.00000
Sn9 Sn 0.42019 0.29748 0.71767 1.00000
Sn10 Sn 0.57981 0.70252 0.28233 1.00000
Pt1 Pt 0.25000 0.25000 0.00000 1.00000
Pt2 Pt 0.75000 0.75000 0.00000 1.00000
Pt3 Pt 0.14689 0.35311 0.50000 1.00000
Pt4 Pt 0.85311 0.64689 0.50000 1.00000
Pt5 Pt 0.35311 0.85311 0.20622 1.00000
Pt6 Pt 0.64689 0.14689 0.79378 1.00000
Get direct link