Sm5Ge5Pd2
Alexandria ALEXAlex-ID: agm005665241 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_26_spg12
SmGePd SmGe
2023-06-18 23:59:10.617743
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005665241).
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 agm005665241
data_agm005665241
_cell_length_a 4.34196
_cell_length_b 8.00718
_cell_length_c 8.65919
_cell_angle_alpha 89.22716
_cell_angle_beta 75.48027
_cell_angle_gamma 74.26855
_cell_volume 280.04125
_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 0.00000 0.50000 0.50000 1.00000
Sm2 Sm 0.69232 0.69498 0.92037 1.00000
Sm3 Sm 0.37277 0.93223 0.32223 1.00000
Sm4 Sm 0.62723 0.06777 0.67777 1.00000
Sm5 Sm 0.30768 0.30502 0.07963 1.00000
Ge1 Ge 0.72307 0.21554 0.33833 1.00000
Ge2 Ge 0.94279 0.30188 0.81253 1.00000
Ge3 Ge 0.05721 0.69812 0.18747 1.00000
Ge4 Ge 0.27693 0.78446 0.66167 1.00000
Ge5 Ge 0.00000 0.00000 0.00000 1.00000
Pd1 Pd 0.38949 0.46923 0.75179 1.00000
Pd2 Pd 0.61051 0.53077 0.24821 1.00000
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