Li7Y3Bi4
Alexandria ALEXAlex-ID: agm010103433 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C7_8_spg12
Li3Bi LiYBi Y
2024-03-06 14:57:08.670918
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm010103433).
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 agm010103433
data_agm010103433
_cell_length_a 8.59663
_cell_length_b 8.59663
_cell_length_c 10.85950
_cell_angle_alpha 53.53229
_cell_angle_beta 53.53229
_cell_angle_gamma 31.23961
_cell_volume 327.49067
_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
Li1 Li 0.34433 0.34433 0.99744 1.00000
Li2 Li 0.47895 0.47895 0.33696 1.00000
Li3 Li 0.83959 0.83959 0.42609 1.00000
Li4 Li 0.65567 0.65567 0.00256 1.00000
Li5 Li 0.16041 0.16041 0.57391 1.00000
Li6 Li 0.00000 0.00000 0.50000 1.00000
Li7 Li 0.52105 0.52105 0.66304 1.00000
Y1 Y 0.29079 0.29079 0.74796 1.00000
Y2 Y 0.70921 0.70921 0.25204 1.00000
Y3 Y 0.00000 0.00000 0.00000 1.00000
Bi1 Bi 0.65333 0.65333 0.74810 1.00000
Bi2 Bi 0.34667 0.34667 0.25190 1.00000
Bi3 Bi 0.88920 0.88920 0.83125 1.00000
Bi4 Bi 0.11080 0.11080 0.16875 1.00000
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