Tb3NdEr4
Alexandria ALEXAlex-ID: agm017183887 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4_439_spg12
Tb2NdEr6 Tb4NdEr Tb5Er4
2025-03-29 17:16:39
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017183887).
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 agm017183887
data_agm017183887
_cell_length_a 12.00454
_cell_length_b 12.00454
_cell_length_c 6.15766
_cell_angle_alpha 75.13993
_cell_angle_beta 104.86007
_cell_angle_gamma 162.90880
_cell_volume 251.87086
_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
Tb1 Tb 0.50000 0.50000 0.50000 1.00000
Tb2 Tb 0.37368 0.62632 0.03798 1.00000
Tb3 Tb 0.62632 0.37368 0.96202 1.00000
Nd1 Nd 0.00000 0.00000 0.00000 1.00000
Er1 Er 0.12618 0.87382 0.46265 1.00000
Er2 Er 0.87382 0.12618 0.53735 1.00000
Er3 Er 0.25066 0.74934 0.25090 1.00000
Er4 Er 0.74934 0.25066 0.74910 1.00000
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