Tb2NiB2Rh5
Alexandria ALEXAlex-ID: agm005137809 · Space group: P4/mbm (#127)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D5_48_spg127
TbNiBRh2 TbBRh3
2022-07-14 14:06:01.158845
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005137809).
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 agm005137809
data_agm005137809
_cell_length_a 3.21412
_cell_length_b 9.43962
_cell_length_c 9.43962
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 286.39899
_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 0.67641 0.17641 1.00000
Tb2 Tb 0.00000 0.32359 0.82359 1.00000
Tb3 Tb 0.00000 0.17641 0.32359 1.00000
Tb4 Tb 0.00000 0.82359 0.67641 1.00000
Ni1 Ni 0.00000 0.00000 0.00000 1.00000
Ni2 Ni 0.00000 0.50000 0.50000 1.00000
B1 B 0.00000 0.12428 0.62428 1.00000
B2 B 0.00000 0.87572 0.37572 1.00000
B3 B 0.00000 0.62428 0.87572 1.00000
B4 B 0.00000 0.37572 0.12428 1.00000
Rh1 Rh 0.50000 0.21913 0.06969 1.00000
Rh2 Rh 0.50000 0.78087 0.93031 1.00000
Rh3 Rh 0.50000 0.06969 0.78087 1.00000
Rh4 Rh 0.50000 0.71913 0.43031 1.00000
Rh5 Rh 0.50000 0.93031 0.21913 1.00000
Rh6 Rh 0.50000 0.28087 0.56969 1.00000
Rh7 Rh 0.50000 0.56969 0.71913 1.00000
Rh8 Rh 0.50000 0.43031 0.28087 1.00000
Rh9 Rh 0.50000 0.50000 0.00000 1.00000
Rh10 Rh 0.50000 0.00000 0.50000 1.00000
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