La3ZnCo2
Alexandria ALEXAlex-ID: agm005676840 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_59_spg14
La7Co3 LaZnCo LaCo
2023-08-17 15:32:15.990651
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005676840).
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 agm005676840
data_agm005676840
_cell_length_a 8.11806
_cell_length_b 8.62475
_cell_length_c 8.64316
_cell_angle_alpha 90.00000
_cell_angle_beta 102.62821
_cell_angle_gamma 90.00000
_cell_volume 590.52183
_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 0.30758 0.96285 0.06828 1.00000
La2 La 0.19242 0.46285 0.43172 1.00000
La3 La 0.69242 0.03715 0.93172 1.00000
La4 La 0.80758 0.53715 0.56828 1.00000
La5 La 0.34647 0.53757 0.10266 1.00000
La6 La 0.15353 0.03757 0.39734 1.00000
La7 La 0.65353 0.46243 0.89734 1.00000
La8 La 0.84647 0.96243 0.60266 1.00000
La9 La 0.89066 0.72485 0.16084 1.00000
La10 La 0.60934 0.22485 0.33916 1.00000
La11 La 0.10934 0.27515 0.83916 1.00000
La12 La 0.39066 0.77515 0.66084 1.00000
Zn1 Zn 0.58114 0.77778 0.32020 1.00000
Zn2 Zn 0.91886 0.27778 0.17980 1.00000
Zn3 Zn 0.41886 0.22222 0.67980 1.00000
Zn4 Zn 0.08114 0.72222 0.82020 1.00000
Co1 Co 0.75903 0.00063 0.25216 1.00000
Co2 Co 0.74097 0.50063 0.24784 1.00000
Co3 Co 0.24097 0.99937 0.74784 1.00000
Co4 Co 0.25903 0.49937 0.75216 1.00000
Co5 Co 0.26947 0.75606 0.29900 1.00000
Co6 Co 0.23053 0.25606 0.20100 1.00000
Co7 Co 0.73053 0.24394 0.70100 1.00000
Co8 Co 0.76947 0.74394 0.79900 1.00000
