Mg2TiCo2
Alexandria ALEXAlex-ID: agm013799643 · Space group: I4/mmm (#139)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_443_spg139
Mg2TiCo2
2025-04-15 01:45:42
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm013799643).
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 agm013799643
data_agm013799643
_cell_length_a 8.64828
_cell_length_b 8.64828
_cell_length_c 8.64828
_cell_angle_alpha 160.08553
_cell_angle_beta 160.08553
_cell_angle_gamma 28.30883
_cell_volume 75.00947
_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
Mg1 Mg 0.82079 0.82079 0.00000 1.00000
Mg2 Mg 0.17921 0.17921 0.00000 1.00000
Ti1 Ti 0.00000 0.00000 0.00000 1.00000
Co1 Co 0.58182 0.58182 0.00000 1.00000
Co2 Co 0.41818 0.41818 0.00000 1.00000
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