La4Nd3Pb4
Alexandria ALEXAlex-ID: agm010019782 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_6_spg12
La4NdPb3 Nd5Pb3 Nd
2024-07-18 13:04:15.728010
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010019782).
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 agm010019782
data_agm010019782
_cell_length_a 14.75498
_cell_length_b 14.75498
_cell_length_c 6.45190
_cell_angle_alpha 99.41943
_cell_angle_beta 99.41943
_cell_angle_gamma 16.65541
_cell_volume 397.04496
_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 0.44009 0.44009 0.48534 1.00000
La2 La 0.55991 0.55991 0.51466 1.00000
La3 La 0.68448 0.68448 0.82121 1.00000
La4 La 0.31552 0.31552 0.17879 1.00000
Nd1 Nd 0.84642 0.84642 0.69299 1.00000
Nd2 Nd 0.15358 0.15358 0.30701 1.00000
Nd3 Nd 0.00000 0.00000 0.00000 1.00000
Pb1 Pb 0.41596 0.41596 0.96616 1.00000
Pb2 Pb 0.73985 0.73985 0.31883 1.00000
Pb3 Pb 0.26015 0.26015 0.68117 1.00000
Pb4 Pb 0.58404 0.58404 0.03384 1.00000
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