La2NdPb2
Alexandria ALEXAlex-ID: agm003399991 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_1019_spg12
La4Pb3 La4NdPb3 Nd5Pb3
2022-02-11 00:29:07.743505
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003399991).
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 agm003399991
data_agm003399991
_cell_length_a 4.99041
_cell_length_b 7.08955
_cell_length_c 10.77874
_cell_angle_alpha 77.42898
_cell_angle_beta 76.61500
_cell_angle_gamma 69.39304
_cell_volume 343.34843
_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 0.31781 0.27571 0.08868 1.00000
La2 La 0.49210 0.33914 0.67666 1.00000
La3 La 0.68219 0.72429 0.91132 1.00000
La4 La 0.50790 0.66086 0.32334 1.00000
Nd1 Nd 0.78986 0.07456 0.34571 1.00000
Nd2 Nd 0.21014 0.92544 0.65429 1.00000
Pb1 Pb 0.95794 0.19424 0.88989 1.00000
Pb2 Pb 0.13117 0.31415 0.42350 1.00000
Pb3 Pb 0.04206 0.80576 0.11011 1.00000
Pb4 Pb 0.86883 0.68585 0.57650 1.00000
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