Cs3In8Ge3
Alexandria ALEXAlex-ID: agm008501972 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B3C8_19_spg12
CsIn3 Cs4Ge23 In
2024-03-15 03:49:54.684935
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm008501972).
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 agm008501972
data_agm008501972
_cell_length_a 10.14559
_cell_length_b 10.14559
_cell_length_c 11.47234
_cell_angle_alpha 70.91306
_cell_angle_beta 70.91306
_cell_angle_gamma 25.73564
_cell_volume 483.05634
_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
Cs1 Cs 0.28890 0.28890 0.14702 1.00000
Cs2 Cs 0.71110 0.71110 0.85298 1.00000
Cs3 Cs 0.00000 0.00000 0.50000 1.00000
In1 In 0.16330 0.16330 0.60872 1.00000
In2 In 0.83670 0.83670 0.39128 1.00000
In3 In 0.90097 0.90097 0.87820 1.00000
In4 In 0.09903 0.09903 0.12180 1.00000
In5 In 0.46449 0.46449 0.20371 1.00000
In6 In 0.53551 0.53551 0.79629 1.00000
In7 In 0.32318 0.32318 0.57606 1.00000
In8 In 0.67682 0.67682 0.42394 1.00000
Ge1 Ge 0.00000 0.00000 0.00000 1.00000
Ge2 Ge 0.60657 0.60657 0.24468 1.00000
Ge3 Ge 0.39343 0.39343 0.75532 1.00000
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