Nd(Y5Ho2)2
Alexandria ALEXAlex-ID: agm005997171 · Space group: I4/m (#87)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C10_7_spg87
NdY2 Nd2Ho7 Y5Ho
2023-08-08 18:17:06.958596
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005997171).
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 agm005997171
data_agm005997171
_cell_length_a 7.69596
_cell_length_b 9.43863
_cell_length_c 9.43862
_cell_angle_alpha 80.43265
_cell_angle_beta 65.94053
_cell_angle_gamma 65.94053
_cell_volume 571.66143
_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 0.00000 0.00000 0.00000 1.00000
Y1 Y 0.25000 0.50000 0.50000 1.00000
Y2 Y 0.64730 0.30267 0.89996 1.00000
Y3 Y 0.05003 0.10004 0.30267 1.00000
Y4 Y 0.45274 0.89996 0.69733 1.00000
Y5 Y 0.84992 0.69733 0.10004 1.00000
Y6 Y 0.35270 0.69733 0.10004 1.00000
Y7 Y 0.75000 0.50000 0.50000 1.00000
Y8 Y 0.15008 0.30267 0.89996 1.00000
Y9 Y 0.54726 0.10004 0.30267 1.00000
Y10 Y 0.94997 0.89996 0.69733 1.00000
Ho1 Ho 0.40101 0.79837 0.39960 1.00000
Ho2 Ho 0.80062 0.60040 0.79837 1.00000
Ho3 Ho 0.19938 0.39960 0.20163 1.00000
Ho4 Ho 0.59899 0.20163 0.60040 1.00000
Get direct link