Pm2(HoBi)3
Alexandria ALEXAlex-ID: agm010010754 · Space group: P6_3/mcm (#193)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C3_5_spg193
Pm3Ho2Bi3 Ho5Bi3
2024-03-31 15:02:02
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010010754).
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 agm010010754
data_agm010010754
_cell_length_a 9.29401
_cell_length_b 9.29401
_cell_length_c 6.40902
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.00000
_cell_volume 479.43436
_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 0.33333 0.66667 0.00000 1.00000
Pm2 Pm 0.66667 0.33333 0.50000 1.00000
Pm3 Pm 0.66667 0.33333 0.00000 1.00000
Pm4 Pm 0.33333 0.66667 0.50000 1.00000
Ho1 Ho 0.24282 0.00000 0.75000 1.00000
Ho2 Ho 0.75718 0.75718 0.75000 1.00000
Ho3 Ho 0.00000 0.24282 0.75000 1.00000
Ho4 Ho 0.75718 0.00000 0.25000 1.00000
Ho5 Ho 0.24282 0.24282 0.25000 1.00000
Ho6 Ho 0.00000 0.75718 0.25000 1.00000
Bi1 Bi 0.61619 0.00000 0.75000 1.00000
Bi2 Bi 0.38381 0.38381 0.75000 1.00000
Bi3 Bi 0.00000 0.61619 0.75000 1.00000
Bi4 Bi 0.38381 0.00000 0.25000 1.00000
Bi5 Bi 0.61619 0.61619 0.25000 1.00000
Bi6 Bi 0.00000 0.38381 0.25000 1.00000
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