MnH8Os2Rh
Alexandria ALEXAlex-ID: agm007197319 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_1868_spg12
MnH2 H8Rh3 Os H2
2024-03-26 09:19:29.273104
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007197319).
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 agm007197319
data_agm007197319
_cell_length_a 4.80507
_cell_length_b 4.99123
_cell_length_c 4.88897
_cell_angle_alpha 78.53461
_cell_angle_beta 119.64999
_cell_angle_gamma 114.14672
_cell_volume 92.98333
_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
Mn1 Mn 0.00000 0.00000 0.00000 1.00000
H1 H 0.81871 0.38852 0.30799 1.00000
H2 H 0.51962 0.39138 0.69640 1.00000
H3 H 0.18129 0.61148 0.69201 1.00000
H4 H 0.73554 0.18315 0.64435 1.00000
H5 H 0.26446 0.81685 0.35565 1.00000
H6 H 0.08804 0.17910 0.35783 1.00000
H7 H 0.91196 0.82090 0.64217 1.00000
H8 H 0.48038 0.60862 0.30360 1.00000
Os1 Os 0.64791 0.99860 0.30361 1.00000
Os2 Os 0.35209 0.00140 0.69639 1.00000
Rh1 Rh 0.50000 0.50000 0.00000 1.00000
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