Pm6Dy2Sc3
Alexandria ALEXAlex-ID: agm005606017 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C6_212_spg2
Pm3Dy5 Pm Sc
2023-06-12 22:47:20.338249
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005606017).
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 agm005606017
data_agm005606017
_cell_length_a 7.87409
_cell_length_b 8.64904
_cell_length_c 12.68859
_cell_angle_alpha 47.13745
_cell_angle_beta 72.37044
_cell_angle_gamma 111.80081
_cell_volume 339.76946
_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 0.09164 0.62780 0.73276 1.00000
Pm2 Pm 0.73354 0.09470 0.81549 1.00000
Pm3 Pm 0.90836 0.37220 0.26724 1.00000
Pm4 Pm 0.26646 0.90530 0.18451 1.00000
Pm5 Pm 0.80137 0.71884 0.54936 1.00000
Pm6 Pm 0.19863 0.28116 0.45064 1.00000
Dy1 Dy 0.64367 0.45776 0.08834 1.00000
Dy2 Dy 0.35633 0.54224 0.91166 1.00000
Sc1 Sc 0.00000 0.00000 0.00000 1.00000
Sc2 Sc 0.54483 0.80739 0.36798 1.00000
Sc3 Sc 0.45517 0.19261 0.63202 1.00000
Get direct link