TbH4Ru
Alexandria ALEXAlex-ID: agm005771544 · Space group: Cmcm (#63)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_2341_spg63
Tb2H4Ru TbH5Ru Ru
2023-07-10 00:36:00.642985
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005771544).
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 agm005771544
data_agm005771544
_cell_length_a 3.75514
_cell_length_b 3.75514
_cell_length_c 8.37885
_cell_angle_alpha 89.99988
_cell_angle_beta 89.99986
_cell_angle_gamma 69.58323
_cell_volume 110.72866
_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 0.00002 0.99998 0.50000 1.00000
Tb2 Tb 0.00002 0.99998 0.00000 1.00000
H1 H 0.86120 0.35703 0.75000 1.00000
H2 H 0.64467 0.64461 0.04732 1.00000
H3 H 0.64467 0.64462 0.45268 1.00000
H4 H 0.35538 0.35533 0.54732 1.00000
H5 H 0.35539 0.35533 0.95268 1.00000
H6 H 0.35686 0.86119 0.75000 1.00000
H7 H 0.64296 0.13879 0.25000 1.00000
H8 H 0.13881 0.64314 0.25000 1.00000
Ru1 Ru 0.64718 0.64717 0.25000 1.00000
Ru2 Ru 0.35283 0.35282 0.75000 1.00000
Get direct link