La5Zn2Cu5
Alexandria ALEXAlex-ID: agm005666041 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_19_spg12
LaZn LaCu2 LaCu
2023-06-19 02:25:10.315654
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005666041).
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 agm005666041
data_agm005666041
_cell_length_a 4.21612
_cell_length_b 8.25994
_cell_length_c 8.71837
_cell_angle_alpha 87.57417
_cell_angle_beta 76.00746
_cell_angle_gamma 75.21361
_cell_volume 284.79043
_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 0.00000 0.50000 0.50000 1.00000
La2 La 0.68384 0.72481 0.90750 1.00000
La3 La 0.38404 0.91467 0.31725 1.00000
La4 La 0.61596 0.08533 0.68275 1.00000
La5 La 0.31616 0.27519 0.09250 1.00000
Zn1 Zn 0.37871 0.47075 0.77183 1.00000
Zn2 Zn 0.62129 0.52925 0.22817 1.00000
Cu1 Cu 0.71345 0.22474 0.34837 1.00000
Cu2 Cu 0.92230 0.31360 0.84180 1.00000
Cu3 Cu 0.07770 0.68640 0.15820 1.00000
Cu4 Cu 0.28655 0.77526 0.65163 1.00000
Cu5 Cu 0.00000 0.00000 0.00000 1.00000
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