AcDyY5
Alexandria ALEXAlex-ID: agm005756362 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC5_381_spg15
DyY5 Ac
2023-07-15 08:24:27.036512
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005756362).
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 agm005756362
data_agm005756362
_cell_length_a 7.09150
_cell_length_b 8.64297
_cell_length_c 8.64297
_cell_angle_alpha 98.81199
_cell_angle_beta 102.31464
_cell_angle_gamma 102.31464
_cell_volume 494.56954
_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 0.75000 0.34558 0.15442 1.00000
Ac2 Ac 0.25000 0.65442 0.84558 1.00000
Dy1 Dy 0.00000 0.00000 0.00000 1.00000
Dy2 Dy 0.50000 0.50000 0.50000 1.00000
Y1 Y 0.53366 0.89722 0.65495 1.00000
Y2 Y 0.63995 0.77756 0.23418 1.00000
Y3 Y 0.03366 0.15495 0.39722 1.00000
Y4 Y 0.75000 0.61180 0.88820 1.00000
Y5 Y 0.86005 0.26582 0.72244 1.00000
Y6 Y 0.13995 0.73418 0.27756 1.00000
Y7 Y 0.25000 0.38820 0.11180 1.00000
Y8 Y 0.96634 0.84505 0.60278 1.00000
Y9 Y 0.36005 0.22244 0.76582 1.00000
Y10 Y 0.46634 0.10278 0.34505 1.00000
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