SnGeAu4
Alexandria ALEXAlex-ID: agm003756243 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC4_1665_spg12
Au Ge SnAu
2022-05-04 15:37:50.741956
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003756243).
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 agm003756243
data_agm003756243
_cell_length_a 6.45795
_cell_length_b 5.75450
_cell_length_c 7.35733
_cell_angle_alpha 113.02125
_cell_angle_beta 84.13771
_cell_angle_gamma 90.00000
_cell_volume 250.08565
_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
Sn1 Sn 0.70924 0.76270 0.52540 1.00000
Sn2 Sn 0.29076 0.23730 0.47460 1.00000
Ge1 Ge 0.22090 0.61858 0.23717 1.00000
Ge2 Ge 0.77910 0.38142 0.76283 1.00000
Au1 Au 0.11085 0.81008 0.62016 1.00000
Au2 Au 0.42618 0.15274 0.80935 1.00000
Au3 Au 1.00000 0.24421 1.00000 1.00000
Au4 Au 0.57382 0.34339 0.19065 1.00000
Au5 Au 0.88915 0.18992 0.37984 1.00000
Au6 Au 0.57382 0.84726 0.19065 1.00000
Au7 Au 0.00000 0.75579 0.00000 1.00000
Au8 Au 0.42618 0.65661 0.80935 1.00000
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