Y10Ge6H
Alexandria ALEXAlex-ID: agm073034282 · Space group: P-31m (#162)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C10_1_spg162
Y4Ge3 Y5Ge3 YH2
2024-10-29 01:08:30
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm073034282).
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 agm073034282
data_agm073034282
_cell_length_a 8.53488
_cell_length_b 8.53488
_cell_length_c 6.36415
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.00000
_cell_volume 401.48159
_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 0.00000 0.24616 0.74765 1.00000
Y2 Y 0.00000 0.75384 0.25235 1.00000
Y3 Y 0.75384 0.75384 0.74765 1.00000
Y4 Y 0.24616 0.24616 0.25235 1.00000
Y5 Y 0.24616 0.00000 0.74765 1.00000
Y6 Y 0.75384 0.00000 0.25235 1.00000
Y7 Y 0.33333 0.66667 0.00000 1.00000
Y8 Y 0.66667 0.33333 0.00000 1.00000
Y9 Y 0.33333 0.66667 0.50000 1.00000
Y10 Y 0.66667 0.33333 0.50000 1.00000
Ge1 Ge 0.00000 0.39074 0.25079 1.00000
Ge2 Ge 0.00000 0.60926 0.74921 1.00000
Ge3 Ge 0.60926 0.60926 0.25079 1.00000
Ge4 Ge 0.39074 0.39074 0.74921 1.00000
Ge5 Ge 0.39074 0.00000 0.25079 1.00000
Ge6 Ge 0.60926 0.00000 0.74921 1.00000
H1 H 0.00000 0.00000 0.00000 1.00000
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