Y2Ga6Cu2Ge3
Alexandria ALEXAlex-ID: agm009166398 · Space group: I4mm (#107)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3D6_7_spg107
YGa3 Y(CuGe)2 Y(GaCu)6 Ge
2024-03-11 01:15:38.666477
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009166398).
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 agm009166398
data_agm009166398
_cell_length_a 15.05465
_cell_length_b 15.05465
_cell_length_c 15.05465
_cell_angle_alpha 164.05230
_cell_angle_beta 164.05230
_cell_angle_gamma 22.62748
_cell_volume 257.53424
_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
Y1 Y 0.85811 0.85811 0.00000 1.00000
Y2 Y 0.11401 0.11401 0.00000 1.00000
Ga1 Ga 0.94329 0.44329 0.50000 1.00000
Ga2 Ga 0.44329 0.94329 0.50000 1.00000
Ga3 Ga 0.03941 0.53941 0.50000 1.00000
Ga4 Ga 0.53941 0.03941 0.50000 1.00000
Ga5 Ga 0.76209 0.26209 0.50000 1.00000
Ga6 Ga 0.26209 0.76209 0.50000 1.00000
Cu1 Cu 0.99391 0.99391 0.00000 1.00000
Cu2 Cu 0.39721 0.39721 0.00000 1.00000
Ge1 Ge 0.62057 0.62057 0.00000 1.00000
Ge2 Ge 0.31849 0.31849 0.00000 1.00000
Ge3 Ge 0.70814 0.70814 0.00000 1.00000
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