Dy2YAg3
Alexandria ALEXAlex-ID: agm017647394 · Space group: Imma (#74)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_4613_spg9
DyY4Ag5 Dy4YAg5
2024-11-26 13:44:57.484898
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017647394).
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 agm017647394
data_agm017647394
_cell_length_a 8.92467
_cell_length_b 8.92467
_cell_length_c 8.92467
_cell_angle_alpha 146.50291
_cell_angle_beta 131.86940
_cell_angle_gamma 59.91072
_cell_volume 289.49228
_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 0.91658 0.16658 0.75000 1.00000
Dy2 Dy 0.25034 0.50034 0.75000 1.00000
Dy3 Dy 0.08342 0.83342 0.25000 1.00000
Dy4 Dy 0.74966 0.49966 0.25000 1.00000
Y1 Y 0.58307 0.83307 0.75000 1.00000
Y2 Y 0.41693 0.16693 0.25000 1.00000
Ag1 Ag 0.66905 0.66613 0.00293 1.00000
Ag2 Ag 0.83680 0.33387 0.50293 1.00000
Ag3 Ag 0.00000 0.00000 0.00000 1.00000
Ag4 Ag 0.33095 0.33387 0.99707 1.00000
Ag5 Ag 0.50000 0.00000 0.50000 1.00000
Ag6 Ag 0.16320 0.66613 0.49707 1.00000
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