Al2H7Rh
Alexandria ALEXAlex-ID: agm006206243 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_819_spg1
AlH9 AlH3 AlRh
2023-12-15 14:06:24
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006206243).
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 agm006206243
data_agm006206243
_cell_length_a 6.56540
_cell_length_b 4.77335
_cell_length_c 6.38818
_cell_angle_alpha 127.62259
_cell_angle_beta 43.16061
_cell_angle_gamma 134.52744
_cell_volume 95.59996
_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 0.16999 0.82373 0.27075 1.00000
H2 H 0.03623 0.09181 0.71709 1.00000
H3 H 0.50250 0.58012 0.74475 1.00000
H4 H 0.03881 0.16475 0.18125 1.00000
H5 H 0.35574 0.69548 0.44681 1.00000
H6 H 0.70071 0.33465 0.26204 1.00000
H7 H 0.69892 0.44685 0.89609 1.00000
Rh1 Rh 0.09267 0.39831 0.01057 1.00000
Al1 Al 0.09621 0.74415 0.84128 1.00000
Al2 Al 0.54062 0.77752 0.09753 1.00000
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