AcDy7Y3
Alexandria ALEXAlex-ID: agm005974209 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C7_251_spg2
Dy5Y DyY5 Ac
2023-08-12 22:44:32.024255
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005974209).
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 agm005974209
data_agm005974209
_cell_length_a 6.72201
_cell_length_b 6.54574
_cell_length_c 8.67708
_cell_angle_alpha 79.75735
_cell_angle_beta 81.47701
_cell_angle_gamma 94.72505
_cell_volume 369.23607
_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
Ac1 Ac 0.50000 0.50000 0.50000 1.00000
Dy1 Dy 0.78937 0.26057 0.21950 1.00000
Dy2 Dy 0.74878 0.98449 0.59815 1.00000
Dy3 Dy 0.29346 0.45256 0.13532 1.00000
Dy4 Dy 0.70654 0.54744 0.86468 1.00000
Dy5 Dy 0.00000 0.50000 0.50000 1.00000
Dy6 Dy 0.25122 0.01551 0.40185 1.00000
Dy7 Dy 0.21063 0.73943 0.78050 1.00000
Y1 Y 0.93251 0.79591 0.15290 1.00000
Y2 Y 0.50000 0.00000 0.00000 1.00000
Y3 Y 0.06749 0.20409 0.84710 1.00000
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