PrDy3Bi2
Alexandria ALEXAlex-ID: agm003423909 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_904_spg12
Pr3Dy2Bi3 Dy5Bi3 Dy
2022-02-13 23:59:44.794981
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003423909).
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 agm003423909
data_agm003423909
_cell_length_a 4.40199
_cell_length_b 10.85645
_cell_length_c 9.96361
_cell_angle_alpha 124.69214
_cell_angle_beta 90.00000
_cell_angle_gamma 101.69701
_cell_volume 379.42182
_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
Pr1 Pr 0.88826 0.77653 0.89640 1.00000
Pr2 Pr 0.11174 0.22347 0.10360 1.00000
Dy1 Dy 0.31171 0.62341 0.51259 1.00000
Dy2 Dy 0.94220 0.88440 0.55553 1.00000
Dy3 Dy 0.63914 0.27827 0.80142 1.00000
Dy4 Dy 0.36086 0.72173 0.19858 1.00000
Dy5 Dy 0.05780 0.11560 0.44447 1.00000
Dy6 Dy 0.68829 0.37659 0.48741 1.00000
Bi1 Bi 0.48833 0.97667 0.81931 1.00000
Bi2 Bi 0.51167 0.02333 0.18069 1.00000
Bi3 Bi 0.75350 0.50700 0.21687 1.00000
Bi4 Bi 0.24650 0.49300 0.78313 1.00000
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