DyY2
Alexandria ALEXAlex-ID: agm027775652 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2_211_spg64
Dy5Y DyY5
2025-01-03 20:01:19
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm027775652).
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
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# CIF generated by HEAS from Alexandria entry agm027775652
data_agm027775652
_cell_length_a 6.22196
_cell_length_b 7.19621
_cell_length_c 8.84181
_cell_angle_alpha 101.74759
_cell_angle_beta 96.73810
_cell_angle_gamma 90.00314
_cell_volume 384.80186
_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
Dy1 Dy 0.60983 0.66667 0.16552 1.00000
Dy2 Dy 0.88985 0.08349 0.83439 1.00000
Dy3 Dy 0.11015 0.91651 0.16561 1.00000
Dy4 Dy 0.39017 0.33333 0.83448 1.00000
Y1 Y 0.88823 0.58375 0.83507 1.00000
Y2 Y 0.50000 0.00000 0.50000 1.00000
Y3 Y 0.00114 0.24978 0.50087 1.00000
Y4 Y 0.99886 0.75022 0.49913 1.00000
Y5 Y 0.11177 0.41625 0.16493 1.00000
Y6 Y 0.38789 0.83383 0.83494 1.00000
Y7 Y 0.50000 0.50000 0.50000 1.00000
Y8 Y 0.61211 0.16617 0.16506 1.00000
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