Mg2Zn2Au3
Alexandria ALEXAlex-ID: agm009672906 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_25_spg12
Mg5ZnAu6 Mg3ZnAu4 Zn3Au
2024-03-06 17:19:20.664618
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009672906).
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
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# CIF generated by HEAS from Alexandria entry agm009672906
data_agm009672906
_cell_length_a 4.65025
_cell_length_b 4.61546
_cell_length_c 7.10430
_cell_angle_alpha 79.83965
_cell_angle_beta 108.97789
_cell_angle_gamma 120.13183
_cell_volume 124.69154
_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
Mg1 Mg 0.41413 0.67520 0.15222 1.00000
Mg2 Mg 0.58587 0.32480 0.84778 1.00000
Zn1 Zn 0.20518 0.01710 0.39215 1.00000
Zn2 Zn 0.79482 0.98290 0.60785 1.00000
Au1 Au 0.00000 0.00000 0.00000 1.00000
Au2 Au 0.18447 0.65021 0.72069 1.00000
Au3 Au 0.81553 0.34979 0.27931 1.00000
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