Sm2Ag4Pd3
Alexandria ALEXAlex-ID: agm005654476 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_1067_spg12
Sm14Ag51 Sm2AgPd5 Ag
2023-06-27 21:11:49.267999
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005654476).
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 agm005654476
data_agm005654476
_cell_length_a 4.28253
_cell_length_b 5.46292
_cell_length_c 8.55318
_cell_angle_alpha 76.40477
_cell_angle_beta 75.50193
_cell_angle_gamma 66.92329
_cell_volume 176.10951
_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 0.32989 0.10485 0.23537 1.00000
Sm2 Sm 0.67011 0.89515 0.76463 1.00000
Ag1 Ag 0.66837 0.55204 0.11123 1.00000
Ag2 Ag 0.00388 0.33253 0.65971 1.00000
Ag3 Ag 0.99612 0.66747 0.34029 1.00000
Ag4 Ag 0.33163 0.44796 0.88877 1.00000
Pd1 Pd 0.34376 0.75793 0.55455 1.00000
Pd2 Pd 0.00000 0.00000 0.00000 1.00000
Pd3 Pd 0.65624 0.24207 0.44545 1.00000
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