Y5(GeH)2
Alexandria ALEXAlex-ID: agm006399073 · Space group: Ima2 (#46)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_1_spg46
Y Y5Ge3 YH2
2024-02-27 00:15:42
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006399073).
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 agm006399073
data_agm006399073
_cell_length_a 9.99499
_cell_length_b 9.99499
_cell_length_c 9.99499
_cell_angle_alpha 143.02501
_cell_angle_beta 134.70797
_cell_angle_gamma 59.84164
_cell_volume 422.64747
_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 0.21164 0.65127 0.02165 1.00000
Y2 Y 0.37038 0.34873 0.56037 1.00000
Y3 Y 0.71164 0.68998 0.56037 1.00000
Y4 Y 0.87038 0.31002 0.02165 1.00000
Y5 Y 0.21223 0.90800 0.84048 1.00000
Y6 Y 0.93248 0.09200 0.30423 1.00000
Y7 Y 0.71223 0.87175 0.30423 1.00000
Y8 Y 0.43248 0.12825 0.84048 1.00000
Y9 Y 0.75214 0.42406 0.67620 1.00000
Y10 Y 0.25214 0.57594 0.32808 1.00000
Ge1 Ge 0.05662 0.00000 0.05662 1.00000
Ge2 Ge 0.55662 0.50000 0.05662 1.00000
Ge3 Ge 0.06896 0.17900 0.74796 1.00000
Ge4 Ge 0.56896 0.82100 0.88997 1.00000
H1 H 0.65325 0.21331 0.61960 1.00000
H2 H 0.40629 0.78669 0.43994 1.00000
H3 H 0.15325 0.53365 0.43994 1.00000
H4 H 0.90629 0.46635 0.61960 1.00000
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