Pm3Dy8Er3
Alexandria ALEXAlex-ID: agm005694529 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C8_31_spg71
Dy7Er2 Pm2Dy7 Pm2Dy5Er2
2023-06-29 11:01:24.056823
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005694529).
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 agm005694529
data_agm005694529
_cell_length_a 5.63290
_cell_length_b 9.63727
_cell_length_c 9.63691
_cell_angle_alpha 101.78053
_cell_angle_beta 73.00891
_cell_angle_gamma 73.00910
_cell_volume 453.86185
_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 0.50000 0.00000 0.00000 1.00000
Pm2 Pm 0.00000 0.81804 0.18195 1.00000
Pm3 Pm 1.00000 0.18196 0.81805 1.00000
Dy1 Dy 0.65987 0.11917 0.56081 1.00000
Dy2 Dy 0.34013 0.88083 0.43919 1.00000
Dy3 Dy 0.65987 0.56080 0.11918 1.00000
Dy4 Dy 0.34013 0.43920 0.88082 1.00000
Dy5 Dy 0.84155 0.76128 0.55589 1.00000
Dy6 Dy 0.15845 0.23872 0.44411 1.00000
Dy7 Dy 0.84154 0.55589 0.76128 1.00000
Dy8 Dy 0.15846 0.44411 0.23872 1.00000
Er1 Er 0.50000 0.50000 0.50000 1.00000
Er2 Er 0.79615 0.20387 0.20387 1.00000
Er3 Er 0.20385 0.79613 0.79613 1.00000
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