Li2Cu2Au
Alexandria ALEXAlex-ID: agm005961971 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_194_spg12
Li5Au3 Li3Au Cu
2023-08-03 20:34:15.788515
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005961971).
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 agm005961971
data_agm005961971
_cell_length_a 3.88307
_cell_length_b 5.99342
_cell_length_c 4.59747
_cell_angle_alpha 129.60992
_cell_angle_beta 114.98014
_cell_angle_gamma 90.00005
_cell_volume 68.94243
_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
Li1 Li 0.40656 0.20429 0.81311 1.00000
Li2 Li 0.59344 0.79571 0.18689 1.00000
Cu1 Cu 0.19463 0.58715 0.38927 1.00000
Cu2 Cu 0.80537 0.41285 0.61073 1.00000
Au1 Au 0.00000 0.00000 0.00000 1.00000
