SrLa4Sb5
Alexandria ALEXAlex-ID: agm006133403 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C5_34_spg71
LaSb SrSb
2023-10-18 04:34:53
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006133403).
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 agm006133403
data_agm006133403
_cell_length_a 4.64170
_cell_length_b 6.56941
_cell_length_c 12.34201
_cell_angle_alpha 105.43470
_cell_angle_beta 100.83869
_cell_angle_gamma 90.00000
_cell_volume 355.80434
_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
Sr1 Sr 0.00000 0.00000 0.00000 1.00000
La1 La 0.40120 0.40120 0.80241 1.00000
La2 La 0.79909 0.79909 0.59818 1.00000
La3 La 0.20091 0.20091 0.40182 1.00000
La4 La 0.59880 0.59880 0.19759 1.00000
Sb1 Sb 0.60542 0.10542 0.21085 1.00000
Sb2 Sb 0.80127 0.30127 0.60254 1.00000
Sb3 Sb 0.19873 0.69873 0.39746 1.00000
Sb4 Sb 0.00000 0.50000 0.00000 1.00000
Sb5 Sb 0.39458 0.89458 0.78915 1.00000
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