SmSiPd3
Alexandria ALEXAlex-ID: agm069493650 · Space group: I4mm (#107)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_4_spg107
Sm4SiPd12 Sm3(Si3Pd10)2 Sm(SiPd)2
2024-11-09 00:28:29.168587
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm069493650).
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 agm069493650
data_agm069493650
_cell_length_a 6.21343
_cell_length_b 6.21343
_cell_length_c 6.21343
_cell_angle_alpha 141.69507
_cell_angle_beta 141.69507
_cell_angle_gamma 55.28839
_cell_volume 91.49128
_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 0.00564 0.00564 0.00000 1.00000
Si1 Si 0.37871 0.37871 0.00000 1.00000
Pd1 Pd 0.76256 0.26256 0.50000 1.00000
Pd2 Pd 0.26256 0.76256 0.50000 1.00000
Pd3 Pd 0.59052 0.59052 0.00000 1.00000
