Tb2PrNd3
Alexandria ALEXAlex-ID: agm003408906 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_871_spg71
PrNd2 Tb4PrNd3 Nd
2022-02-13 23:58:53.136363
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003408906).
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 agm003408906
data_agm003408906
_cell_length_a 3.51293
_cell_length_b 6.04318
_cell_length_c 10.49209
_cell_angle_alpha 106.73749
_cell_angle_beta 99.63719
_cell_angle_gamma 90.00000
_cell_volume 210.01840
_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 0.63844 0.63844 0.27688 1.00000
Tb2 Tb 0.36156 0.36156 0.72312 1.00000
Pr1 Pr 0.00000 0.00000 0.00000 1.00000
Nd1 Nd 0.00000 0.50000 0.00000 1.00000
Nd2 Nd 0.80924 0.80924 0.61849 1.00000
Nd3 Nd 0.19076 0.19076 0.38151 1.00000
Get direct link