Tb5Ho5Th2
Alexandria ALEXAlex-ID: agm005646568 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_137_spg2
Tb3Ho3Th2 Ho2Th Tb2Ho
2023-06-19 08:10:22.313649
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005646568).
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 agm005646568
data_agm005646568
_cell_length_a 6.13801
_cell_length_b 7.95682
_cell_length_c 10.60850
_cell_angle_alpha 98.67196
_cell_angle_beta 55.10394
_cell_angle_gamma 74.98267
_cell_volume 380.07491
_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
Tb1 Tb 0.00000 0.50000 0.50000 1.00000
Tb2 Tb 0.67051 0.74558 0.91848 1.00000
Tb3 Tb 0.33588 0.99585 0.33347 1.00000
Tb4 Tb 0.66412 0.00415 0.66653 1.00000
Tb5 Tb 0.32949 0.25442 0.08152 1.00000
Ho1 Ho 0.66448 0.25283 0.41779 1.00000
Ho2 Ho 0.99893 0.25276 0.75373 1.00000
Ho3 Ho 0.00107 0.74724 0.24627 1.00000
Ho4 Ho 0.33552 0.74717 0.58221 1.00000
Ho5 Ho 0.00000 0.00000 0.00000 1.00000
Th1 Th 0.32877 0.50075 0.83381 1.00000
Th2 Th 0.67123 0.49925 0.16619 1.00000
Get direct link