Ti2Fe2Co5
Alexandria ALEXAlex-ID: agm009852454 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_220_spg12
Fe5Co3 TiFe2 TiCo3
2024-04-20 04:38:02.869514
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009852454).
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 agm009852454
data_agm009852454
_cell_length_a 5.68683
_cell_length_b 5.68683
_cell_length_c 5.76679
_cell_angle_alpha 72.23102
_cell_angle_beta 72.23102
_cell_angle_gamma 37.40050
_cell_volume 107.23529
_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
Ti1 Ti 0.56054 0.56054 0.69159 1.00000
Ti2 Ti 0.43946 0.43946 0.30841 1.00000
Fe1 Fe 0.87847 0.87847 0.67452 1.00000
Fe2 Fe 0.12153 0.12153 0.32548 1.00000
Co1 Co 0.67207 0.67207 0.00694 1.00000
Co2 Co 0.32793 0.32793 0.99306 1.00000
Co3 Co 0.77500 0.77500 0.32333 1.00000
Co4 Co 0.22500 0.22500 0.67667 1.00000
Co5 Co 0.00000 0.00000 0.00000 1.00000
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