Zn2Sn2H5
Alexandria ALEXAlex-ID: agm007368487 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C5_1071_spg2
SnH2 Sn ZnH2
2024-02-09 07:30:01
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007368487).
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 agm007368487
data_agm007368487
_cell_length_a 2.99344
_cell_length_b 6.71927
_cell_length_c 7.50640
_cell_angle_alpha 115.61763
_cell_angle_beta 80.46065
_cell_angle_gamma 88.12645
_cell_volume 133.33006
_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
Zn1 Zn 0.35161 0.46351 0.84757 1.00000
Zn2 Zn 0.71304 0.56961 0.15629 1.00000
Sn1 Sn 0.05391 0.14698 0.27999 1.00000
Sn2 Sn 0.37430 0.88176 0.68996 1.00000
H1 H 0.40139 0.57255 0.68318 1.00000
H2 H 0.04110 0.41276 0.24810 1.00000
H3 H 0.35194 0.18519 0.71012 1.00000
H4 H 0.50121 0.77011 0.39012 1.00000
H5 H 0.21151 0.99754 0.99468 1.00000
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