Nd5Dy2
Alexandria ALEXAlex-ID: agm035840004 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5_157_spg69
Nd3Dy5 Nd
2025-04-22 20:48:59
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm035840004).
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
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# CIF generated by HEAS from Alexandria entry agm035840004
data_agm035840004
_cell_length_a 20.75836
_cell_length_b 20.75836
_cell_length_c 20.75836
_cell_angle_alpha 10.13585
_cell_angle_beta 10.13585
_cell_angle_gamma 10.13585
_cell_volume 240.53650
_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 0.85750 0.85750 0.85750 1.00000
Nd2 Nd 0.71506 0.71506 0.71506 1.00000
Nd3 Nd 0.28494 0.28494 0.28494 1.00000
Nd4 Nd 0.14250 0.14250 0.14250 1.00000
Nd5 Nd 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.57149 0.57149 0.57149 1.00000
Dy2 Dy 0.42851 0.42851 0.42851 1.00000
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