Sr3In9Pb2
Alexandria ALEXAlex-ID: agm005606608 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C9_126_spg71
SrIn2 SrPb3 In
2023-06-15 02:10:14.278563
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005606608).
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 agm005606608
data_agm005606608
_cell_length_a 4.93197
_cell_length_b 9.78892
_cell_length_c 9.78892
_cell_angle_alpha 71.38518
_cell_angle_beta 75.40909
_cell_angle_gamma 75.40910
_cell_volume 425.78297
_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
Sr2 Sr 0.68944 0.31056 0.31056 1.00000
Sr3 Sr 0.31056 0.68944 0.68944 1.00000
In1 In 0.00000 0.50000 0.50000 1.00000
In2 In 0.66356 0.96233 0.71054 1.00000
In3 In 0.33644 0.03767 0.28946 1.00000
In4 In 0.66356 0.71054 0.96233 1.00000
In5 In 0.33644 0.28946 0.03767 1.00000
In6 In 0.84971 0.87304 0.42755 1.00000
In7 In 0.15029 0.12696 0.57245 1.00000
In8 In 0.84971 0.42755 0.87304 1.00000
In9 In 0.15029 0.57245 0.12696 1.00000
Pb1 Pb 0.50000 0.29480 0.70520 1.00000
Pb2 Pb 0.50000 0.70520 0.29480 1.00000
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