Dy6Tc2Au
Alexandria ALEXAlex-ID: agm005805931 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_160_spg71
Dy3Tc Dy2Au DyTc2
2023-07-09 18:29:07.098721
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005805931).
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 agm005805931
data_agm005805931
_cell_length_a 8.41205
_cell_length_b 8.41205
_cell_length_c 8.41205
_cell_angle_alpha 106.28155
_cell_angle_beta 111.34653
_cell_angle_gamma 110.83235
_cell_volume 457.16330
_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 0.53339 0.71967 0.81372 1.00000
Dy2 Dy 0.46661 0.28033 0.18628 1.00000
Dy3 Dy 0.09406 0.28033 0.81372 1.00000
Dy4 Dy 0.90594 0.71967 0.18628 1.00000
Dy5 Dy 0.79637 0.76747 0.56384 1.00000
Dy6 Dy 0.20363 0.23253 0.43616 1.00000
Dy7 Dy 0.20363 0.76747 0.97110 1.00000
Dy8 Dy 0.79637 0.23253 0.02890 1.00000
Dy9 Dy 0.70883 0.39020 0.68137 1.00000
Dy10 Dy 0.29117 0.60980 0.31863 1.00000
Dy11 Dy 0.29117 0.97254 0.68137 1.00000
Dy12 Dy 0.70883 0.02746 0.31863 1.00000
Tc1 Tc 0.50000 0.38133 0.88133 1.00000
Tc2 Tc 0.50000 0.61867 0.11867 1.00000
Tc3 Tc 0.63064 1.00000 0.63064 1.00000
Tc4 Tc 0.36936 0.00000 0.36936 1.00000
Au1 Au 0.00000 0.50000 0.50000 1.00000
Au2 Au 0.00000 0.00000 0.00000 1.00000
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