PmDy2Sn3
Alexandria ALEXAlex-ID: agm003418010 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_936_spg15
DySn PmSn
2022-02-14 19:57:46.014438
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003418010).
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 agm003418010
data_agm003418010
_cell_length_a 5.80003
_cell_length_b 8.48430
_cell_length_c 8.48430
_cell_angle_alpha 114.28579
_cell_angle_beta 103.63975
_cell_angle_gamma 103.63975
_cell_volume 342.73125
_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 0.25000 0.58261 0.41739 1.00000
Pm2 Pm 0.75000 0.41739 0.58261 1.00000
Dy1 Dy 0.25000 0.91663 0.08337 1.00000
Dy2 Dy 0.25000 0.25068 0.74932 1.00000
Dy3 Dy 0.75000 0.08337 0.91663 1.00000
Dy4 Dy 0.75000 0.74932 0.25068 1.00000
Sn1 Sn 0.00545 0.16058 0.33126 1.00000
Sn2 Sn 0.50545 0.33126 0.16058 1.00000
Sn3 Sn 0.00000 0.50000 0.00000 1.00000
Sn4 Sn 0.99455 0.83942 0.66874 1.00000
Sn5 Sn 0.50000 0.00000 0.50000 1.00000
Sn6 Sn 0.49455 0.66874 0.83942 1.00000
Get direct link