Tb6Nd5Ho
Alexandria ALEXAlex-ID: agm006118908 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_50_spg71
Tb5Ho Tb5Nd3 Tb2Nd3Ho
2023-09-02 04:44:55.123389
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006118908).
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 agm006118908
data_agm006118908
_cell_length_a 5.10606
_cell_length_b 10.17430
_cell_length_c 9.54315
_cell_angle_alpha 122.16980
_cell_angle_beta 105.48687
_cell_angle_gamma 90.05201
_cell_volume 398.15202
_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 0.66535 0.16543 0.33085 1.00000
Nd2 Nd 0.33343 0.33338 0.66677 1.00000
Nd3 Nd 0.00000 0.50000 0.00000 1.00000
Nd4 Nd 0.66657 0.66662 0.33323 1.00000
Nd5 Nd 0.33465 0.83457 0.66915 1.00000
Tb1 Tb 0.83385 0.58487 0.66763 1.00000
Tb2 Tb 0.83374 0.08268 0.66750 1.00000
Tb3 Tb 0.50009 0.75195 0.00001 1.00000
Tb4 Tb 0.49991 0.24805 0.99999 1.00000
Tb5 Tb 0.16626 0.91732 0.33250 1.00000
Tb6 Tb 0.16615 0.41513 0.33237 1.00000
Ho1 Ho 0.00000 0.00000 0.00000 1.00000
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