Dy6CuBi2
Alexandria ALEXAlex-ID: agm003494017 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_647_spg14
Dy5Bi3 DyCu Dy
2022-02-24 11:55:38.126964
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003494017).
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 agm003494017
data_agm003494017
_cell_length_a 6.41533
_cell_length_b 8.02871
_cell_length_c 10.18606
_cell_angle_alpha 90.00000
_cell_angle_beta 90.26476
_cell_angle_gamma 90.00000
_cell_volume 524.64585
_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 0.86212 0.97113 0.24405 1.00000
Dy2 Dy 0.86832 0.67223 0.53832 1.00000
Dy3 Dy 0.87199 0.69885 0.96008 1.00000
Dy4 Dy 0.62801 0.19885 0.53992 1.00000
Dy5 Dy 0.63168 0.17223 0.96168 1.00000
Dy6 Dy 0.63788 0.47113 0.25595 1.00000
Dy7 Dy 0.13788 0.02887 0.75595 1.00000
Dy8 Dy 0.13168 0.32777 0.46168 1.00000
Dy9 Dy 0.12801 0.30115 0.03992 1.00000
Dy10 Dy 0.37199 0.80115 0.46008 1.00000
Dy11 Dy 0.36832 0.82777 0.03832 1.00000
Dy12 Dy 0.36212 0.52887 0.74405 1.00000
Cu1 Cu 0.50000 0.50000 0.00000 1.00000
Cu2 Cu 0.00000 0.00000 0.50000 1.00000
Bi1 Bi 0.89484 0.38698 0.75728 1.00000
Bi2 Bi 0.60516 0.88698 0.74272 1.00000
Bi3 Bi 0.39484 0.11302 0.25728 1.00000
Bi4 Bi 0.10516 0.61302 0.24272 1.00000
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