YFe2Co3
Alexandria ALEXAlex-ID: agm005702240 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_38_spg63
Fe2Co Y3Fe2Co7
2023-08-17 17:48:23.024372
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005702240).
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 agm005702240
data_agm005702240
_cell_length_a 4.66364
_cell_length_b 6.15070
_cell_length_c 6.15070
_cell_angle_alpha 99.83380
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 173.83837
_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
Y1 Y 0.25000 0.31137 0.31137 1.00000
Y2 Y 0.75000 0.68863 0.68863 1.00000
Fe1 Fe 0.50000 0.78287 0.21713 1.00000
Fe2 Fe 0.00000 0.78287 0.21713 1.00000
Fe3 Fe 0.00000 0.21713 0.78287 1.00000
Fe4 Fe 0.50000 0.21713 0.78287 1.00000
Co1 Co 0.75000 0.46012 0.06312 1.00000
Co2 Co 0.75000 0.06312 0.46012 1.00000
Co3 Co 0.25000 0.53988 0.93688 1.00000
Co4 Co 0.75000 0.06346 0.06346 1.00000
Co5 Co 0.25000 0.93654 0.93654 1.00000
Co6 Co 0.25000 0.93688 0.53988 1.00000
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