Sm6In5Pb
Alexandria ALEXAlex-ID: agm006115356 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_53_spg71
Sm4Pb3 Sm3In5 SmIn
2023-08-28 08:15:56.504634
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006115356).
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 agm006115356
data_agm006115356
_cell_length_a 5.45135
_cell_length_b 9.43692
_cell_length_c 9.43692
_cell_angle_alpha 120.38470
_cell_angle_beta 106.84625
_cell_angle_gamma 106.84626
_cell_volume 340.25631
_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
Pb1 Pb 0.00000 0.00000 0.00000 1.00000
Sm1 Sm 0.25038 0.08344 0.41746 1.00000
Sm2 Sm 0.74962 0.58254 0.91656 1.00000
Sm3 Sm 0.75058 0.25073 0.25073 1.00000
Sm4 Sm 0.24942 0.74927 0.74927 1.00000
Sm5 Sm 0.25038 0.41746 0.08344 1.00000
Sm6 Sm 0.74962 0.91656 0.58254 1.00000
In1 In 0.50000 0.16912 0.83088 1.00000
In2 In 0.00000 0.33348 0.66652 1.00000
In3 In 0.50000 0.50000 0.50000 1.00000
In4 In 1.00000 0.66652 0.33348 1.00000
In5 In 0.50000 0.83088 0.16912 1.00000
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