TbTcB14
Alexandria ALEXAlex-ID: agm005755286 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC14_1_spg74
TbB12 TcB2
2023-07-18 14:06:22.011174
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005755286).
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 agm005755286
data_agm005755286
_cell_length_a 5.88443
_cell_length_b 7.40010
_cell_length_c 7.40010
_cell_angle_alpha 67.58482
_cell_angle_beta 66.57229
_cell_angle_gamma 66.57229
_cell_volume 261.58992
_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 0.25000 0.37562 0.12438 1.00000
Tb2 Tb 0.75000 0.62438 0.87562 1.00000
Tc1 Tc 0.50000 0.00000 0.50000 1.00000
Tc2 Tc 0.00000 0.00000 0.50000 1.00000
B1 B 0.66722 0.36820 0.29737 1.00000
B2 B 0.33278 0.63180 0.70263 1.00000
B3 B 0.16722 0.79737 0.86820 1.00000
B4 B 0.83278 0.20263 0.13180 1.00000
B5 B 0.12183 0.24797 0.50838 1.00000
B6 B 0.87817 0.75203 0.49162 1.00000
B7 B 0.62183 0.00838 0.74797 1.00000
B8 B 0.37817 0.99162 0.25203 1.00000
B9 B 0.08297 0.08674 0.74731 1.00000
B10 B 0.91703 0.91326 0.25269 1.00000
B11 B 0.58297 0.24731 0.58674 1.00000
B12 B 0.41703 0.75269 0.41326 1.00000
B13 B 0.72489 0.59802 0.27523 1.00000
B14 B 0.59814 0.40198 0.72477 1.00000
B15 B 0.22489 0.77523 0.09802 1.00000
B16 B 0.09814 0.22477 0.90198 1.00000
B17 B 0.27511 0.40198 0.72477 1.00000
B18 B 0.40186 0.59802 0.27523 1.00000
B19 B 0.77511 0.22477 0.90198 1.00000
B20 B 0.90186 0.77523 0.09802 1.00000
B21 B 0.32418 0.97017 0.87332 1.00000
B22 B 0.16767 0.02983 0.12668 1.00000
B23 B 0.82418 0.37332 0.47017 1.00000
B24 B 0.66767 0.62668 0.52983 1.00000
B25 B 0.67582 0.02983 0.12668 1.00000
B26 B 0.83233 0.97017 0.87332 1.00000
B27 B 0.17582 0.62668 0.52983 1.00000
B28 B 0.33233 0.37332 0.47017 1.00000
