Tm2ZrCo3
Alexandria ALEXAlex-ID: agm017445596 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_1840_spg65
ZrCo TmCo
2025-04-13 18:20:12
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017445596).
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 agm017445596
data_agm017445596
_cell_length_a 7.28837
_cell_length_b 7.28837
_cell_length_c 6.52865
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 143.11957
_cell_volume 208.13351
_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
Tm1 Tm 0.50000 0.50000 0.00000 1.00000
Tm2 Tm 0.50000 0.50000 0.50000 1.00000
Tm3 Tm 0.83372 0.16628 0.50000 1.00000
Tm4 Tm 0.16628 0.83372 0.50000 1.00000
Zr1 Zr 0.83345 0.16655 0.00000 1.00000
Zr2 Zr 0.16655 0.83345 0.00000 1.00000
Co1 Co 0.32790 0.67210 0.76831 1.00000
Co2 Co 0.00000 0.00000 0.23962 1.00000
Co3 Co 0.67210 0.32790 0.23169 1.00000
Co4 Co 0.32790 0.67210 0.23169 1.00000
Co5 Co 0.67210 0.32790 0.76831 1.00000
Co6 Co 0.00000 0.00000 0.76038 1.00000
Get direct link