RbMgH6Os
Alexandria ALEXAlex-ID: agm007660202 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABCD6_671_spg1
Rb3H7Os Rb2H9Os Mg2H6Os Os
2024-02-09 08:09:42
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007660202).
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 agm007660202
data_agm007660202
_cell_length_a 4.97826
_cell_length_b 4.09344
_cell_length_c 6.12263
_cell_angle_alpha 89.56477
_cell_angle_beta 83.31628
_cell_angle_gamma 114.85772
_cell_volume 112.21821
_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
Rb1 Rb 0.92473 0.91340 0.96211 1.00000
Mg1 Mg 0.30332 0.60279 0.45447 1.00000
H1 H 0.96053 0.42751 0.26284 1.00000
H2 H 0.49271 0.41672 0.68988 1.00000
H3 H 0.49447 0.98189 0.68695 1.00000
H4 H 0.94257 0.42655 0.67736 1.00000
H5 H 0.42698 0.16249 0.31159 1.00000
H6 H 0.76341 0.76175 0.46213 1.00000
Os1 Os 0.69153 0.30709 0.49259 1.00000
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