Pm2PrDy6Y
Alexandria ALEXAlex-ID: agm004978596 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_695_spg15
PrDy5 Pm(PrY3)2 Pm3Dy5 Pm3PrDy4
2022-08-06 04:31:37.987681
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004978596).
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 agm004978596
data_agm004978596
_cell_length_a 9.71666
_cell_length_b 8.83182
_cell_length_c 8.83182
_cell_angle_alpha 118.20548
_cell_angle_beta 94.27841
_cell_angle_gamma 94.27841
_cell_volume 660.82789
_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
Pm1 Pm 0.45678 0.80417 0.70078 1.00000
Pm2 Pm 0.04322 0.29922 0.19583 1.00000
Pm3 Pm 0.54322 0.19583 0.29922 1.00000
Pm4 Pm 0.95678 0.70078 0.80417 1.00000
Pr1 Pr 0.25000 0.97990 0.02010 1.00000
Pr2 Pr 0.75000 0.02010 0.97990 1.00000
Dy1 Dy 0.05703 0.12305 0.74288 1.00000
Dy2 Dy 0.44297 0.25712 0.87695 1.00000
Dy3 Dy 0.94297 0.87695 0.25712 1.00000
Dy4 Dy 0.55703 0.74288 0.12305 1.00000
Dy5 Dy 0.31554 0.97877 0.42935 1.00000
Dy6 Dy 0.18446 0.57065 0.02123 1.00000
Dy7 Dy 0.68446 0.02123 0.57065 1.00000
Dy8 Dy 0.81554 0.42935 0.97877 1.00000
Dy9 Dy 0.11977 0.70646 0.49265 1.00000
Dy10 Dy 0.38023 0.50735 0.29354 1.00000
Dy11 Dy 0.88023 0.29354 0.50735 1.00000
Dy12 Dy 0.61977 0.49265 0.70646 1.00000
Y1 Y 0.25000 0.40765 0.59235 1.00000
Y2 Y 0.75000 0.59235 0.40765 1.00000
Get direct link