Sr2ZnH8
Alexandria ALEXAlex-ID: agm003529635 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_694_spg71
SrH10 SrZnH4 SrH2
2023-03-28 18:17:24.493387
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003529635).
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 agm003529635
data_agm003529635
_cell_length_a 4.28312
_cell_length_b 5.21055
_cell_length_c 6.67804
_cell_angle_alpha 112.85993
_cell_angle_beta 108.70447
_cell_angle_gamma 90.00000
_cell_volume 128.74554
_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
Sr1 Sr 0.80339 0.30322 0.60677 1.00000
Sr2 Sr 0.19661 0.69678 0.39323 1.00000
Zn1 Zn 0.50000 0.00000 0.00000 1.00000
H1 H 0.38850 0.65147 0.77700 1.00000
H2 H 0.61212 0.87631 0.22425 1.00000
H3 H 0.79649 0.79602 0.59298 1.00000
H4 H 0.03434 0.03463 0.06868 1.00000
H5 H 0.20351 0.20398 0.40702 1.00000
H6 H 0.38788 0.12369 0.77575 1.00000
H7 H 0.61150 0.34853 0.22300 1.00000
H8 H 0.96566 0.96537 0.93132 1.00000
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