Nd3DyRh3
Alexandria ALEXAlex-ID: agm003545751 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C3_288_spg12
Nd5Rh4 Nd8DyRh6 DyRh
2022-04-04 05:23:44.658917
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003545751).
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 agm003545751
data_agm003545751
_cell_length_a 7.02313
_cell_length_b 7.02313
_cell_length_c 7.14172
_cell_angle_alpha 90.45099
_cell_angle_beta 90.45099
_cell_angle_gamma 96.51408
_cell_volume 349.96229
_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
Nd1 Nd 0.66941 0.66941 0.37669 1.00000
Nd2 Nd 0.18037 0.81963 0.50000 1.00000
Nd3 Nd 0.81963 0.18037 0.50000 1.00000
Nd4 Nd 0.25198 0.74802 0.00000 1.00000
Nd5 Nd 0.74802 0.25198 0.00000 1.00000
Nd6 Nd 0.33059 0.33059 0.62331 1.00000
Dy1 Dy 0.76000 0.76000 0.87475 1.00000
Dy2 Dy 0.24000 0.24000 0.12525 1.00000
Rh1 Rh 0.93744 0.93744 0.19578 1.00000
Rh2 Rh 0.99061 0.50081 0.72714 1.00000
Rh3 Rh 0.50081 0.99061 0.72714 1.00000
Rh4 Rh 0.00939 0.49919 0.27286 1.00000
Rh5 Rh 0.49919 0.00939 0.27286 1.00000
Rh6 Rh 0.06256 0.06256 0.80422 1.00000
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