Tb3Np2Rh3
Alexandria ALEXAlex-ID: agm009355702 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3_168_spg2
Np TbRh
2024-03-07 16:41:32.726207
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009355702).
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 agm009355702
data_agm009355702
_cell_length_a 10.50305
_cell_length_b 10.50305
_cell_length_c 4.82015
_cell_angle_alpha 79.76132
_cell_angle_beta 79.76132
_cell_angle_gamma 19.06936
_cell_volume 170.87766
_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 0.38210 0.38210 0.59111 1.00000
Tb2 Tb 0.61790 0.61790 0.40889 1.00000
Tb3 Tb 0.50000 0.50000 0.00000 1.00000
Np1 Np 0.26388 0.26388 0.15366 1.00000
Np2 Np 0.73612 0.73612 0.84634 1.00000
Rh1 Rh 0.87791 0.87791 0.09827 1.00000
Rh2 Rh 0.00000 0.00000 0.50000 1.00000
Rh3 Rh 0.12209 0.12209 0.90173 1.00000
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