La2PdPt2
Alexandria ALEXAlex-ID: agm002940697 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_106_spg139
La3Pt5 LaPd3 LaPt
2023-03-26 14:51:38.572528
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002940697).
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 agm002940697
data_agm002940697
_cell_length_a 3.89274
_cell_length_b 3.89274
_cell_length_c 8.49443
_cell_angle_alpha 76.75387
_cell_angle_beta 76.75387
_cell_angle_gamma 90.00000
_cell_volume 121.77401
_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
Pd1 Pd 0.00000 0.00000 0.00000 1.00000
Pt1 Pt 0.75000 0.25000 0.50000 1.00000
Pt2 Pt 0.25000 0.75000 0.50000 1.00000
La1 La 0.39028 0.39028 0.21944 1.00000
La2 La 0.60972 0.60972 0.78056 1.00000
