Ga(SbPb2)2
Alexandria ALEXAlex-ID: agm096380360 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_6183_spg47
GaSb Sb Pb
2025-04-10 19:11:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm096380360).
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 agm096380360
data_agm096380360
_cell_length_a 4.51528
_cell_length_b 6.29923
_cell_length_c 7.91138
_cell_angle_alpha 85.05931
_cell_angle_beta 89.90967
_cell_angle_gamma 89.93578
_cell_volume 224.18525
_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
Ga1 Ga 0.00126 0.55885 0.97737 1.00000
Sb1 Sb 0.00064 0.99764 0.00670 1.00000
Sb2 Sb 0.49877 0.00810 0.53562 1.00000
Pb1 Pb 0.50115 0.29909 0.84010 1.00000
Pb2 Pb 0.99903 0.26516 0.32344 1.00000
Pb3 Pb 0.99900 0.66332 0.59459 1.00000
Pb4 Pb 0.50014 0.70784 0.22217 1.00000
Get direct link