SbH6Ru
Alexandria ALEXAlex-ID: agm079945170 · Space group: Amm2 (#38)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC6_365_spg2
H8Ru3 H2 Sb2Ru
2025-06-26 22:46:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm079945170).
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 agm079945170
data_agm079945170
_cell_length_a 3.22634
_cell_length_b 5.61268
_cell_length_c 4.65464
_cell_angle_alpha 89.99272
_cell_angle_beta 89.99952
_cell_angle_gamma 73.35959
_cell_volume 80.75824
_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
Sb1 Sb 0.24898 0.53486 0.53113 1.00000
H1 H 0.36802 0.01466 0.27506 1.00000
H2 H 0.64769 0.01388 0.78794 1.00000
H3 H 0.83679 0.35861 0.03000 1.00000
H4 H 0.24168 0.55005 0.03173 1.00000
H5 H 0.64738 0.01454 0.27509 1.00000
H6 H 0.36836 0.01401 0.78796 1.00000
Ru1 Ru 0.39110 0.24940 0.03108 1.00000
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