Ga2Si2H5
Alexandria ALEXAlex-ID: agm007368188 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_600_spg65
SiH4 Ga Si
2024-02-09 00:05:46
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007368188).
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 agm007368188
data_agm007368188
_cell_length_a 2.81427
_cell_length_b 4.93161
_cell_length_c 8.68313
_cell_angle_alpha 105.20537
_cell_angle_beta 94.37312
_cell_angle_gamma 90.01887
_cell_volume 115.92881
_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
Ga1 Ga 0.79702 0.08954 0.19503 1.00000
Ga2 Ga 0.20298 0.91049 0.80500 1.00000
Si1 Si 0.30547 0.39907 0.78041 1.00000
Si2 Si 0.69453 0.60094 0.21960 1.00000
H1 H 0.72231 0.68517 0.40126 1.00000
H2 H 0.27774 0.31483 0.59875 1.00000
H3 H 0.28261 0.15009 0.32558 1.00000
H4 H 0.71736 0.84989 0.67439 1.00000
H5 H 0.99999 0.99999 0.99999 1.00000
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