La2SmPb2
Alexandria ALEXAlex-ID: agm003398005 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_508_spg12
La4SmPb3 Sm5Pb3 La4Pb3
2022-02-11 00:53:11.041962
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003398005).
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 agm003398005
data_agm003398005
_cell_length_a 4.95785
_cell_length_b 7.04190
_cell_length_c 10.80799
_cell_angle_alpha 78.14100
_cell_angle_beta 76.74058
_cell_angle_gamma 69.38877
_cell_volume 340.52850
_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
La1 La 0.31855 0.27291 0.08998 1.00000
La2 La 0.49104 0.34065 0.67727 1.00000
La3 La 0.68145 0.72709 0.91002 1.00000
La4 La 0.50896 0.65935 0.32273 1.00000
Sm1 Sm 0.78900 0.07151 0.35050 1.00000
Sm2 Sm 0.21100 0.92849 0.64950 1.00000
Pb1 Pb 0.96127 0.18940 0.88807 1.00000
Pb2 Pb 0.13244 0.31217 0.42295 1.00000
Pb3 Pb 0.03873 0.81060 0.11193 1.00000
Pb4 Pb 0.86756 0.68783 0.57705 1.00000
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