Tb2In16Ru9
Alexandria ALEXAlex-ID: agm008295370 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B9C16_1_spg71
In3Ru TbIn3 Ru
2024-07-13 10:58:22.105470
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008295370).
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 agm008295370
data_agm008295370
_cell_length_a 12.20378
_cell_length_b 12.20378
_cell_length_c 12.20378
_cell_angle_alpha 159.37450
_cell_angle_beta 120.24425
_cell_angle_gamma 63.92227
_cell_volume 550.06594
_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 0.21905 0.71905 0.50000 1.00000
Tb2 Tb 0.78095 0.28095 0.50000 1.00000
In1 In 0.26729 0.89771 0.36957 1.00000
In2 In 0.08943 0.41637 0.67306 1.00000
In3 In 0.52118 0.70726 0.81392 1.00000
In4 In 0.25669 0.58363 0.67306 1.00000
In5 In 0.92155 0.92155 0.00000 1.00000
In6 In 0.73271 0.10229 0.63043 1.00000
In7 In 0.89334 0.70726 0.18608 1.00000
In8 In 0.47882 0.29274 0.18608 1.00000
In9 In 0.38140 0.50000 0.88140 1.00000
In10 In 0.61860 0.50000 0.11860 1.00000
In11 In 0.47186 0.10229 0.36957 1.00000
In12 In 0.10666 0.29274 0.81392 1.00000
In13 In 0.91057 0.58363 0.32694 1.00000
In14 In 0.74331 0.41637 0.32694 1.00000
In15 In 0.52814 0.89771 0.63043 1.00000
In16 In 0.07845 0.07845 0.00000 1.00000
Ru1 Ru 0.79466 0.00000 0.79466 1.00000
Ru2 Ru 0.00401 0.83616 0.16785 1.00000
Ru3 Ru 0.62431 0.62431 0.00000 1.00000
Ru4 Ru 0.20534 0.00000 0.20534 1.00000
Ru5 Ru 0.37569 0.37569 0.00000 1.00000
Ru6 Ru 0.00000 0.50000 0.50000 1.00000
Ru7 Ru 0.66831 0.83616 0.83215 1.00000
Ru8 Ru 0.33169 0.16384 0.16785 1.00000
Ru9 Ru 0.99599 0.16384 0.83215 1.00000
