Nd3(YHo)4
Alexandria ALEXAlex-ID: agm005694112 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_71_spg71
NdY2 Nd2Ho7 Y5Ho
2023-06-30 00:46:24.956876
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005694112).
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 agm005694112
data_agm005694112
_cell_length_a 3.56531
_cell_length_b 10.99306
_cell_length_c 10.99306
_cell_angle_alpha 61.50465
_cell_angle_beta 80.66761
_cell_angle_gamma 80.66761
_cell_volume 371.85959
_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 0.89247 0.10753 0.10753 1.00000
Nd2 Nd 0.10753 0.89247 0.89247 1.00000
Nd3 Nd 0.00000 0.50000 0.50000 1.00000
Y1 Y 0.67043 0.09098 0.56816 1.00000
Y2 Y 0.32957 0.43184 0.90902 1.00000
Y3 Y 0.32957 0.90902 0.43184 1.00000
Y4 Y 0.67043 0.56816 0.09098 1.00000
Ho1 Ho 0.77547 0.72453 0.72453 1.00000
Ho2 Ho 0.22453 0.27547 0.27547 1.00000
Ho3 Ho 0.50000 0.79180 0.20820 1.00000
Ho4 Ho 0.50000 0.20820 0.79180 1.00000
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