RbH7Rh2
Alexandria ALEXAlex-ID: agm006201690 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_827_spg8
H8Rh3 Rb3H9Rh2 H2
2023-12-02 10:08:03
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006201690).
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 agm006201690
data_agm006201690
_cell_length_a 3.51502
_cell_length_b 4.60727
_cell_length_c 9.52200
_cell_angle_alpha 105.01468
_cell_angle_beta 70.16630
_cell_angle_gamma 139.58598
_cell_volume 94.04202
_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
H1 H 0.18009 0.85447 0.29410 1.00000
H2 H 0.70390 0.85921 0.70233 1.00000
H3 H 0.71566 0.36164 0.57683 1.00000
H4 H 0.23587 0.35491 0.21157 1.00000
H5 H 0.66599 0.85434 0.50901 1.00000
H6 H 0.25549 0.35508 0.40019 1.00000
H7 H 0.64399 0.36069 0.78165 1.00000
Rh1 Rh 0.24086 0.86012 0.66837 1.00000
Rh2 Rh 0.66784 0.85495 0.32772 1.00000
Rb1 Rb 0.92270 0.34198 0.99640 1.00000
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