Ac2Pr5Dy4
Alexandria ALEXAlex-ID: agm005650138 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_657_spg2
PrDy5 Ac Pr
2023-06-22 11:44:23.541495
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005650138).
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 agm005650138
data_agm005650138
_cell_length_a 6.38995
_cell_length_b 9.84531
_cell_length_c 13.34411
_cell_angle_alpha 125.49940
_cell_angle_beta 143.15964
_cell_angle_gamma 70.60418
_cell_volume 394.36757
_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
Ac1 Ac 0.22528 0.26981 0.31658 1.00000
Ac2 Ac 0.77472 0.73019 0.68342 1.00000
Pr1 Pr 0.31636 0.18420 0.04569 1.00000
Pr2 Pr 0.68364 0.81580 0.95431 1.00000
Pr3 Pr 0.50000 0.00000 0.50000 1.00000
Pr4 Pr 0.94363 0.54517 0.13158 1.00000
Pr5 Pr 0.05637 0.45483 0.86842 1.00000
Dy1 Dy 0.14370 0.36099 0.59306 1.00000
Dy2 Dy 0.85630 0.63901 0.40694 1.00000
Dy3 Dy 0.60956 0.90982 0.23574 1.00000
Dy4 Dy 0.39044 0.09018 0.76426 1.00000
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