LiSmSnPt2
Alexandria ALEXAlex-ID: agm048629045 · Space group: I-4m2 (#119)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD2_37_spg107
Sm3Pt5 Sm15Pt32 Li2SnPt SmSnPt
2025-04-14 11:40:13
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm048629045).
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
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# CIF generated by HEAS from Alexandria entry agm048629045
data_agm048629045
_cell_length_a 6.97777
_cell_length_b 6.97777
_cell_length_c 6.97777
_cell_angle_alpha 146.84547
_cell_angle_beta 146.84547
_cell_angle_gamma 47.59264
_cell_volume 101.21677
_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
Li1 Li 0.25000 0.75000 0.50000 1.00000
Sm1 Sm 0.50000 0.50000 0.00000 1.00000
Sn1 Sn 0.75000 0.25000 0.50000 1.00000
Pt1 Pt 0.10488 0.10488 0.00000 1.00000
Pt2 Pt 0.89512 0.89512 0.00000 1.00000
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