PrNdRh
Alexandria ALEXAlex-ID: agm005647047 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_7727_spg2
Nd5Rh3 Pr7Rh3 Nd7Rh3
2023-06-18 09:37:22.988940
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005647047).
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 agm005647047
data_agm005647047
_cell_length_a 3.91508
_cell_length_b 7.30236
_cell_length_c 8.50933
_cell_angle_alpha 130.95071
_cell_angle_beta 90.00000
_cell_angle_gamma 105.54945
_cell_volume 171.77714
_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
Pr1 Pr 0.55881 0.11762 0.14307 1.00000
Pr2 Pr 0.14626 0.29252 0.62428 1.00000
Nd1 Nd 0.31104 0.62208 0.17644 1.00000
Nd2 Nd 0.90194 0.80388 0.66417 1.00000
Rh1 Rh 0.85388 0.70775 0.95018 1.00000
Rh2 Rh 0.60517 0.21034 0.85503 1.00000
Get direct link