Pm3DyMg3
Alexandria ALEXAlex-ID: agm005993377 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C3_607_spg12
Pm5DyMg6 PmDy8 PmMg
2023-08-07 20:35:43.165906
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005993377).
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 agm005993377
data_agm005993377
_cell_length_a 7.82729
_cell_length_b 7.82729
_cell_length_c 7.05368
_cell_angle_alpha 90.01632
_cell_angle_beta 90.01632
_cell_angle_gamma 92.93146
_cell_volume 431.58835
_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 0.99997 0.99997 0.75381 1.00000
Pm2 Pm 0.50016 0.99987 0.25393 1.00000
Pm3 Pm 0.99987 0.50016 0.25393 1.00000
Pm4 Pm 0.49984 0.00013 0.74607 1.00000
Pm5 Pm 0.00013 0.49984 0.74607 1.00000
Pm6 Pm 0.00003 0.00003 0.24619 1.00000
Dy1 Dy 0.31281 0.31281 0.00040 1.00000
Dy2 Dy 0.68719 0.68719 0.99960 1.00000
Mg1 Mg 0.27641 0.27641 0.50004 1.00000
Mg2 Mg 0.32571 0.67429 0.50000 1.00000
Mg3 Mg 0.67429 0.32571 0.50000 1.00000
Mg4 Mg 0.25642 0.74358 1.00000 1.00000
Mg5 Mg 0.74358 0.25642 0.00000 1.00000
Mg6 Mg 0.72359 0.72359 0.49996 1.00000
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