Tb2Pr5Dy3
Alexandria ALEXAlex-ID: agm005602799 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C5_281_spg15
PrDy5 Tb2Pr3Dy Pr
2023-06-25 06:22:02.399642
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005602799).
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 agm005602799
data_agm005602799
_cell_length_a 10.12621
_cell_length_b 10.12631
_cell_length_c 9.21770
_cell_angle_alpha 108.28019
_cell_angle_beta 108.27958
_cell_angle_gamma 115.40206
_cell_volume 691.23148
_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 0.97468 0.03346 0.75710 1.00000
Tb2 Tb 0.02532 0.96654 0.24290 1.00000
Tb3 Tb 0.28242 0.72363 0.75710 1.00000
Tb4 Tb 0.71758 0.27637 0.24290 1.00000
Pr1 Pr 0.22823 0.47823 0.95645 1.00000
Pr2 Pr 0.77177 0.52177 0.04355 1.00000
Pr3 Pr 0.98164 0.73164 0.46329 1.00000
Pr4 Pr 0.47802 0.22802 0.45603 1.00000
Pr5 Pr 0.01836 0.26836 0.53671 1.00000
Pr6 Pr 0.52198 0.77198 0.54397 1.00000
Pr7 Pr 0.87754 0.63226 0.75866 1.00000
Pr8 Pr 0.12246 0.36774 0.24134 1.00000
Pr9 Pr 0.38112 0.12639 0.75866 1.00000
Pr10 Pr 0.61888 0.87361 0.24134 1.00000
Dy1 Dy 0.27146 0.02146 0.04291 1.00000
Dy2 Dy 0.72854 0.97854 0.95709 1.00000
Dy3 Dy 0.52815 0.47070 0.24913 1.00000
Dy4 Dy 0.47185 0.52930 0.75087 1.00000
Dy5 Dy 0.22098 0.77843 0.24913 1.00000
Dy6 Dy 0.77902 0.22157 0.75087 1.00000
