In5Bi
Alexandria ALEXAlex-ID: agm005545754 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5_33_spg155
Bi In
2023-05-29 05:03:45.720086
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005545754).
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 agm005545754
data_agm005545754
_cell_length_a 5.65421
_cell_length_b 5.99789
_cell_length_c 6.56397
_cell_angle_alpha 65.08666
_cell_angle_beta 64.48799
_cell_angle_gamma 61.87805
_cell_volume 170.39377
_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
In1 In 0.03095 0.93555 0.00254 1.00000
In2 In 0.69452 0.61040 0.00057 1.00000
In3 In 0.35717 0.28881 0.99686 1.00000
In4 In 0.36531 0.78336 0.48602 1.00000
In5 In 0.02434 0.43870 0.51263 1.00000
Bi1 Bi 0.69439 0.10984 0.50138 1.00000
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