La4Al21Pd10
Alexandria ALEXAlex-ID: agm008503523 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A4B10C21_0_spg12
La2Al16Pd9 LaAl3Pd La4(Al8Pd3)3
2025-03-02 06:33:03
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008503523).
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 agm008503523
data_agm008503523
_cell_length_a 11.15878
_cell_length_b 11.15878
_cell_length_c 15.99630
_cell_angle_alpha 56.27771
_cell_angle_beta 123.72229
_cell_angle_gamma 157.55227
_cell_volume 627.01462
_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 0.77241 0.22759 0.17791 1.00000
La2 La 0.22759 0.77241 0.82209 1.00000
La3 La 0.12386 0.87614 0.33846 1.00000
La4 La 0.87614 0.12386 0.66154 1.00000
Al1 Al 0.50000 0.50000 0.50000 1.00000
Al2 Al 0.88524 0.11476 0.44735 1.00000
Al3 Al 0.11476 0.88524 0.55265 1.00000
Al4 Al 0.54131 0.45869 0.37195 1.00000
Al5 Al 0.45869 0.54131 0.62805 1.00000
Al6 Al 0.93524 0.06476 0.20270 1.00000
Al7 Al 0.06476 0.93524 0.79730 1.00000
Al8 Al 0.62671 0.37329 0.19245 1.00000
Al9 Al 0.37329 0.62671 0.80755 1.00000
Al10 Al 0.00572 0.99428 0.09126 1.00000
Al11 Al 0.99428 0.00572 0.90874 1.00000
Al12 Al 0.25193 0.74807 0.29711 1.00000
Al13 Al 0.74807 0.25193 0.70289 1.00000
Al14 Al 0.38881 0.61119 0.29995 1.00000
Al15 Al 0.61119 0.38881 0.70005 1.00000
Al16 Al 0.39904 0.60096 0.00121 1.00000
Al17 Al 0.60096 0.39904 0.99879 1.00000
Al18 Al 0.80371 0.19629 0.00086 1.00000
Al19 Al 0.19629 0.80371 0.99914 1.00000
Al20 Al 0.29962 0.70038 0.49570 1.00000
Al21 Al 0.70038 0.29962 0.50430 1.00000
Pd1 Pd 0.75262 0.24738 0.38559 1.00000
Pd2 Pd 0.24738 0.75262 0.61441 1.00000
Pd3 Pd 0.97609 0.02391 0.39012 1.00000
Pd4 Pd 0.02391 0.97609 0.60988 1.00000
Pd5 Pd 0.34478 0.65522 0.10843 1.00000
Pd6 Pd 0.65522 0.34478 0.89157 1.00000
Pd7 Pd 0.12986 0.87014 0.10289 1.00000
Pd8 Pd 0.87014 0.12986 0.89711 1.00000
Pd9 Pd 0.50396 0.49604 0.18392 1.00000
Pd10 Pd 0.49604 0.50396 0.81608 1.00000
