Pm2ErBi3
Alexandria ALEXAlex-ID: agm033997368 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_1990_spg44
ErBi PmBi
2025-03-02 00:50:54
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm033997368).
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 agm033997368
data_agm033997368
_cell_length_a 7.85580
_cell_length_b 7.85580
_cell_length_c 7.85580
_cell_angle_alpha 146.46801
_cell_angle_beta 131.72975
_cell_angle_gamma 60.05321
_cell_volume 198.03563
_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 0.33185 0.33185 0.00000 1.00000
Pm2 Pm 0.66815 0.66815 0.00000 1.00000
Er1 Er 0.00000 0.00000 0.00000 1.00000
Bi1 Bi 0.83817 0.33817 0.50000 1.00000
Bi2 Bi 0.16183 0.66183 0.50000 1.00000
Bi3 Bi 0.50000 0.00000 0.50000 1.00000
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