Sr4H8Br
Alexandria ALEXAlex-ID: agm097486247 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_2185_spg8
Sr7(H6Br)2 SrH10 SrH2
2025-06-21 19:44:14
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097486247).
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 agm097486247
data_agm097486247
_cell_length_a 4.16715
_cell_length_b 7.21493
_cell_length_c 8.52828
_cell_angle_alpha 114.30668
_cell_angle_beta 104.04534
_cell_angle_gamma 89.94838
_cell_volume 225.26765
_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 0.99071 0.18155 0.13247 1.00000
Sr2 Sr 0.17551 0.99822 0.50727 1.00000
Sr3 Sr 0.48465 0.63698 0.11992 1.00000
Sr4 Sr 0.68437 0.53693 0.52329 1.00000
H1 H 0.15865 0.31649 0.47154 1.00000
H2 H 0.91021 0.41415 0.96783 1.00000
H3 H 0.09720 0.59403 0.34849 1.00000
H4 H 0.76175 0.22740 0.68349 1.00000
H5 H 0.52511 0.34795 0.20213 1.00000
H6 H 0.71085 0.20792 0.58020 1.00000
H7 H 0.01727 0.86984 0.18643 1.00000
H8 H 0.64805 0.82818 0.45137 1.00000
Br1 Br 0.33565 0.84036 0.82557 1.00000
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