Mg2Zn5Au4
Alexandria ALEXAlex-ID: agm005674112 · Space group: Fmmm (#69)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B4C5_154_spg69
Mg5ZnAu6 Mg3ZnAu4 Zn3Au
2023-06-22 02:34:37.069106
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005674112).
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 agm005674112
data_agm005674112
_cell_length_a 5.20512
_cell_length_b 5.07078
_cell_length_c 9.35112
_cell_angle_alpha 81.78754
_cell_angle_beta 73.84032
_cell_angle_gamma 59.11969
_cell_volume 203.45637
_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 0.88324 1.00000 0.23352 1.00000
Mg2 Mg 0.11676 0.00000 0.76648 1.00000
Zn1 Zn 0.50000 0.00000 0.00000 1.00000
Zn2 Zn 0.00000 0.50000 0.00000 1.00000
Zn3 Zn 0.50000 0.50000 0.00000 1.00000
Zn4 Zn 0.25000 0.50000 0.50000 1.00000
Zn5 Zn 0.75000 0.50000 0.50000 1.00000
Au1 Au 0.79456 0.66903 0.74185 1.00000
Au2 Au 0.20544 0.33097 0.25815 1.00000
Au3 Au 0.53641 0.66903 0.25815 1.00000
Au4 Au 0.46359 0.33097 0.74185 1.00000
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