Pr5Dy2Er5
Alexandria ALEXAlex-ID: agm005649898 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_18_spg12
PrDyEr4 PrDy5 Pr
2023-06-19 06:05:09.063701
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005649898).
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 agm005649898
data_agm005649898
_cell_length_a 5.07526
_cell_length_b 10.79959
_cell_length_c 8.05994
_cell_angle_alpha 98.58569
_cell_angle_beta 71.64854
_cell_angle_gamma 76.40986
_cell_volume 395.44903
_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
Pr1 Pr 0.66722 0.25131 0.41425 1.00000
Pr2 Pr 0.99842 0.25055 0.75262 1.00000
Pr3 Pr 0.00158 0.74945 0.24738 1.00000
Pr4 Pr 0.33278 0.74869 0.58575 1.00000
Pr5 Pr 0.00000 0.00000 0.00000 1.00000
Dy1 Dy 0.33237 0.50110 0.83417 1.00000
Dy2 Dy 0.66763 0.49890 0.16583 1.00000
Er1 Er 0.00000 0.50000 0.50000 1.00000
Er2 Er 0.66818 0.74736 0.91628 1.00000
Er3 Er 0.33282 0.99999 0.33437 1.00000
Er4 Er 0.66718 0.00001 0.66563 1.00000
Er5 Er 0.33182 0.25264 0.08372 1.00000
Get direct link