Pm8(DyTh)3
Alexandria ALEXAlex-ID: agm005694786 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C8_31_spg71
DyTh Pm
2023-06-29 11:15:17.442404
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005694786).
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 agm005694786
data_agm005694786
_cell_length_a 5.76541
_cell_length_b 9.74011
_cell_length_c 9.74011
_cell_angle_alpha 103.25424
_cell_angle_beta 72.78501
_cell_angle_gamma 72.78501
_cell_volume 467.99362
_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 0.65726 0.11939 0.56609 1.00000
Pm2 Pm 0.34274 0.88061 0.43391 1.00000
Pm3 Pm 0.65726 0.56609 0.11939 1.00000
Pm4 Pm 0.34274 0.43391 0.88061 1.00000
Pm5 Pm 0.83408 0.76868 0.56316 1.00000
Pm6 Pm 0.16592 0.23132 0.43684 1.00000
Pm7 Pm 0.83408 0.56316 0.76868 1.00000
Pm8 Pm 0.16592 0.43684 0.23132 1.00000
Dy1 Dy 0.50000 0.50000 0.50000 1.00000
Dy2 Dy 0.81386 0.18613 0.18613 1.00000
Dy3 Dy 0.18614 0.81387 0.81387 1.00000
Th1 Th 0.50000 0.00000 0.00000 1.00000
Th2 Th 0.00000 0.81667 0.18333 1.00000
Th3 Th 1.00000 0.18333 0.81667 1.00000
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