Pm2Y5Bi4
Alexandria ALEXAlex-ID: agm003359652 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_200_spg12
Pm5Y5Bi6 Y5Bi3 Y
2022-02-05 19:49:50.242400
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003359652).
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 agm003359652
data_agm003359652
_cell_length_a 3.48812
_cell_length_b 8.23839
_cell_length_c 15.52546
_cell_angle_alpha 125.37787
_cell_angle_beta 96.44997
_cell_angle_gamma 90.00000
_cell_volume 360.29787
_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 0.05258 0.75782 0.10517 1.00000
Pm2 Pm 0.94742 0.24218 0.89483 1.00000
Y1 Y 0.17999 0.85889 0.35998 1.00000
Y2 Y 0.82001 0.14111 0.64002 1.00000
Y3 Y 0.14977 0.26503 0.29954 1.00000
Y4 Y 0.50000 0.00000 0.00000 1.00000
Y5 Y 0.85023 0.73497 0.70046 1.00000
Bi1 Bi 0.73333 0.67961 0.46667 1.00000
Bi2 Bi 0.92666 0.58659 0.85332 1.00000
Bi3 Bi 0.26667 0.32039 0.53333 1.00000
Bi4 Bi 0.07334 0.41341 0.14668 1.00000
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