La5TbPb6
Alexandria ALEXAlex-ID: agm006116748 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_47_spg65
La2Tb3Pb4 LaPb2 LaPb
2023-09-17 04:53:28.038611
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006116748).
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 agm006116748
data_agm006116748
_cell_length_a 5.15139
_cell_length_b 9.29238
_cell_length_c 8.16357
_cell_angle_alpha 89.99846
_cell_angle_beta 72.28437
_cell_angle_gamma 89.99066
_cell_volume 372.24794
_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 0.83614 0.75323 0.32790 1.00000
Pb2 Pb 0.83614 0.24677 0.32790 1.00000
Pb3 Pb 0.49999 0.24720 0.00000 1.00000
Pb4 Pb 0.50001 0.75280 1.00000 1.00000
Pb5 Pb 0.16386 0.75323 0.67210 1.00000
Pb6 Pb 0.16386 0.24677 0.67210 1.00000
Tb1 Tb 0.00000 0.00000 0.00000 1.00000
La1 La 0.66756 0.50000 0.66488 1.00000
La2 La 0.33519 0.00000 0.33003 1.00000
La3 La 0.00000 0.50000 0.00000 1.00000
La4 La 0.66481 1.00000 0.66997 1.00000
La5 La 0.33244 0.50000 0.33512 1.00000
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