Pm2(Dy2Sc)3
Alexandria ALEXAlex-ID: agm005606003 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C6_250_spg12
Pm2Dy7 Pm3Dy5 Sc
2023-06-12 21:34:39.192926
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005606003).
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 agm005606003
data_agm005606003
_cell_length_a 5.99305
_cell_length_b 5.99866
_cell_length_c 11.39496
_cell_angle_alpha 84.94009
_cell_angle_beta 79.83055
_cell_angle_gamma 60.03094
_cell_volume 349.30463
_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 0.16663 0.66674 0.50000 1.00000
Pm2 Pm 0.83337 0.33326 0.50000 1.00000
Dy1 Dy 0.41341 0.66629 0.76087 1.00000
Dy2 Dy 0.74710 0.00000 0.76034 1.00000
Dy3 Dy 0.07970 0.33371 0.76087 1.00000
Dy4 Dy 0.25290 0.00000 0.23966 1.00000
Dy5 Dy 0.58659 0.33371 0.23913 1.00000
Dy6 Dy 0.92030 0.66629 0.23913 1.00000
Sc1 Sc 0.00000 0.00000 0.00000 1.00000
Sc2 Sc 0.33469 0.33061 0.00000 1.00000
Sc3 Sc 0.66531 0.66939 0.00000 1.00000
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