PmDy2Bi3
Alexandria ALEXAlex-ID: agm005661114 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_4_spg71
PmDy3Bi4 Pm2DyBi3
2023-08-24 05:43:46.131645
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005661114).
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
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# CIF generated by HEAS from Alexandria entry agm005661114
data_agm005661114
_cell_length_a 4.51112
_cell_length_b 6.37890
_cell_length_c 7.81347
_cell_angle_alpha 114.09173
_cell_angle_beta 106.77871
_cell_angle_gamma 89.99999
_cell_volume 194.72269
_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
Pm1 Pm 0.50000 0.50000 0.50000 1.00000
Dy1 Dy 0.83452 0.83452 0.16904 1.00000
Dy2 Dy 0.16548 0.16548 0.83096 1.00000
Bi1 Bi 0.82953 0.32953 0.15905 1.00000
Bi2 Bi 0.17047 0.67047 0.84095 1.00000
Bi3 Bi 0.50000 0.00000 0.50000 1.00000
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