Tm3Al2Co
Alexandria ALEXAlex-ID: agm005753207 · Space group: Pnma (#62)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_315_spg62
Tm3Al5Co Tm4AlCo TmAl2Co
2023-08-07 03:12:19.615326
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005753207).
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 agm005753207
data_agm005753207
_cell_length_a 3.66352
_cell_length_b 12.10563
_cell_length_c 12.27117
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 544.21645
_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 0.25000 0.38088 0.03941 1.00000
Tm2 Tm 0.75000 0.61912 0.96059 1.00000
Tm3 Tm 0.75000 0.88088 0.46059 1.00000
Tm4 Tm 0.25000 0.11912 0.53941 1.00000
Tm5 Tm 0.25000 0.72192 0.23994 1.00000
Tm6 Tm 0.75000 0.27808 0.76006 1.00000
Tm7 Tm 0.75000 0.22192 0.26006 1.00000
Tm8 Tm 0.25000 0.77808 0.73994 1.00000
Tm9 Tm 0.25000 0.46116 0.38214 1.00000
Tm10 Tm 0.75000 0.53884 0.61786 1.00000
Tm11 Tm 0.75000 0.96116 0.11786 1.00000
Tm12 Tm 0.25000 0.03884 0.88214 1.00000
Al1 Al 0.25000 0.68921 0.48910 1.00000
Al2 Al 0.75000 0.31079 0.51090 1.00000
Al3 Al 0.75000 0.18921 0.01090 1.00000
Al4 Al 0.25000 0.81079 0.98910 1.00000
Al5 Al 0.25000 0.01251 0.30912 1.00000
Al6 Al 0.75000 0.98749 0.69088 1.00000
Al7 Al 0.75000 0.51251 0.19088 1.00000
Al8 Al 0.25000 0.48749 0.80912 1.00000
Co1 Co 0.25000 0.12289 0.13553 1.00000
Co2 Co 0.75000 0.87711 0.86447 1.00000
Co3 Co 0.75000 0.62289 0.36447 1.00000
Co4 Co 0.25000 0.37711 0.63553 1.00000
