La3(Pt2Au)2
Alexandria ALEXAlex-ID: agm005646819 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_33_spg2
LaPtAu La3Pt5 La15Pt32
2023-06-27 07:46:15.783117
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005646819).
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 agm005646819
data_agm005646819
_cell_length_a 4.25964
_cell_length_b 6.29581
_cell_length_c 9.36813
_cell_angle_alpha 114.95807
_cell_angle_beta 90.00000
_cell_angle_gamma 109.77283
_cell_volume 211.32180
_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 0.64393 0.28787 0.69162 1.00000
La2 La 0.00000 0.00000 0.00000 1.00000
La3 La 0.35607 0.71213 0.30838 1.00000
Pt1 Pt 0.70467 0.40934 0.05149 1.00000
Pt2 Pt 0.29533 0.59066 0.94851 1.00000
Pt3 Pt 0.93060 0.86121 0.57958 1.00000
Pt4 Pt 0.06940 0.13879 0.42042 1.00000
Au1 Au 0.64728 0.29456 0.30514 1.00000
Au2 Au 0.35272 0.70544 0.69486 1.00000
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