Dy4Mg3In2
Alexandria ALEXAlex-ID: agm005640164 · Space group: P-3m1 (#164)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_138_spg12
DyMg3 DyMgIn Dy2MgIn
2023-06-30 20:27:30.960326
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005640164).
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 agm005640164
data_agm005640164
_cell_length_a 5.26265
_cell_length_b 5.26325
_cell_length_c 10.05818
_cell_angle_alpha 90.00255
_cell_angle_beta 89.99460
_cell_angle_gamma 60.00602
_cell_volume 241.28750
_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 0.66669 0.66661 0.87784 1.00000
Dy2 Dy 0.00004 0.99991 0.32576 1.00000
Dy3 Dy 0.99996 0.00009 0.67424 1.00000
Dy4 Dy 0.33331 0.33339 0.12216 1.00000
Mg1 Mg 0.33314 0.33352 0.48713 1.00000
Mg2 Mg 0.00000 0.00000 0.00000 1.00000
Mg3 Mg 0.66686 0.66648 0.51287 1.00000
In1 In 0.33331 0.33336 0.79980 1.00000
In2 In 0.66669 0.66664 0.20020 1.00000
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