Dy3Er2In3
Alexandria ALEXAlex-ID: agm009772689 · Space group: P6_3/mcm (#193)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3_61_spg193
Er2In Er3In2 Dy5In3
2024-05-04 06:00:54.191375
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009772689).
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 agm009772689
data_agm009772689
_cell_length_a 9.05352
_cell_length_b 9.05352
_cell_length_c 6.48142
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.00000
_cell_volume 460.08241
_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 0.00000 0.23524 0.75000 1.00000
Dy2 Dy 0.23524 0.00000 0.75000 1.00000
Dy3 Dy 0.76476 0.76476 0.75000 1.00000
Dy4 Dy 0.00000 0.76476 0.25000 1.00000
Dy5 Dy 0.76476 0.00000 0.25000 1.00000
Dy6 Dy 0.23524 0.23524 0.25000 1.00000
Er1 Er 0.33333 0.66667 0.00000 1.00000
Er2 Er 0.66667 0.33333 0.50000 1.00000
Er3 Er 0.66667 0.33333 0.00000 1.00000
Er4 Er 0.33333 0.66667 0.50000 1.00000
In1 In 0.00000 0.59688 0.75000 1.00000
In2 In 0.59688 0.00000 0.75000 1.00000
In3 In 0.40312 0.40312 0.75000 1.00000
In4 In 0.00000 0.40312 0.25000 1.00000
In5 In 0.40312 0.00000 0.25000 1.00000
In6 In 0.59688 0.59688 0.25000 1.00000
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