NdDy5Ho
Alexandria ALEXAlex-ID: agm005757852 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC5_370_spg15
NdDy4Ho NdDy8 Dy5Ho
2023-07-14 14:35:25.844295
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005757852).
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 agm005757852
data_agm005757852
_cell_length_a 6.75845
_cell_length_b 6.75845
_cell_length_c 13.63256
_cell_angle_alpha 61.88544
_cell_angle_beta 61.88544
_cell_angle_gamma 59.96227
_cell_volume 452.30516
_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 0.71957 0.28043 0.75000 1.00000
Nd2 Nd 0.28043 0.71957 0.25000 1.00000
Dy1 Dy 0.15920 0.39487 0.75392 1.00000
Dy2 Dy 0.65374 0.68919 0.49954 1.00000
Dy3 Dy 0.39487 0.15920 0.25392 1.00000
Dy4 Dy 0.15917 0.84083 0.75000 1.00000
Dy5 Dy 0.31081 0.34626 0.00046 1.00000
Dy6 Dy 0.68919 0.65374 0.99954 1.00000
Dy7 Dy 0.84083 0.15917 0.25000 1.00000
Dy8 Dy 0.60513 0.84080 0.74608 1.00000
Dy9 Dy 0.34626 0.31081 0.50046 1.00000
Dy10 Dy 0.84080 0.60513 0.24608 1.00000
Ho1 Ho 0.00000 0.00000 0.00000 1.00000
Ho2 Ho 0.00000 0.00000 0.50000 1.00000
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