La3FeAg
Alexandria ALEXAlex-ID: agm005756020 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC3_5484_spg12
La5FeAg2 La4Fe Fe
2023-07-09 10:06:38.680701
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005756020).
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 agm005756020
data_agm005756020
_cell_length_a 8.40172
_cell_length_b 8.40172
_cell_length_c 8.82796
_cell_angle_alpha 88.49072
_cell_angle_beta 88.49072
_cell_angle_gamma 27.12836
_cell_volume 284.04571
_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 0.55127 0.55127 0.20711 1.00000
La2 La 0.89896 0.89896 0.43871 1.00000
La3 La 0.10104 0.10104 0.56129 1.00000
La4 La 0.44873 0.44873 0.79289 1.00000
La5 La 0.74320 0.74320 0.80780 1.00000
La6 La 0.25680 0.25680 0.19220 1.00000
Fe1 Fe 0.73282 0.73282 0.46315 1.00000
Fe2 Fe 0.26718 0.26718 0.53685 1.00000
Ag1 Ag 0.90828 0.90828 0.06431 1.00000
Ag2 Ag 0.09172 0.09172 0.93569 1.00000
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