Nd7Y2
Alexandria ALEXAlex-ID: agm009561391 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B7_158_spg12
NdY2 Nd
2024-05-05 23:38:01.424841
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009561391).
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 agm009561391
data_agm009561391
_cell_length_a 8.17087
_cell_length_b 8.17087
_cell_length_c 8.19329
_cell_angle_alpha 72.51741
_cell_angle_beta 72.51741
_cell_angle_gamma 36.90076
_cell_volume 311.53531
_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 0.44369 0.44369 0.33360 1.00000
Nd2 Nd 0.55631 0.55631 0.66640 1.00000
Nd3 Nd 0.11160 0.11160 0.33425 1.00000
Nd4 Nd 0.88840 0.88840 0.66575 1.00000
Nd5 Nd 0.00000 0.00000 0.00000 1.00000
Nd6 Nd 0.33348 0.33348 0.99867 1.00000
Nd7 Nd 0.66652 0.66652 0.00133 1.00000
Y1 Y 0.22225 0.22225 0.66617 1.00000
Y2 Y 0.77775 0.77775 0.33383 1.00000
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