Mn8Si4Rh
Alexandria ALEXAlex-ID: agm097620575 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_692_spg1
Mn3Si MnSi SiRh
2025-06-18 20:51:38
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097620575).
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 agm097620575
data_agm097620575
_cell_length_a 3.76014
_cell_length_b 7.17148
_cell_length_c 6.92211
_cell_angle_alpha 117.38404
_cell_angle_beta 90.00784
_cell_angle_gamma 89.99899
_cell_volume 165.74343
_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 0.76914 0.86232 0.23503 1.00000
Mn2 Mn 0.76919 0.44229 0.16057 1.00000
Mn3 Mn 0.76934 0.23487 0.61175 1.00000
Mn4 Mn 0.76931 0.91844 0.64954 1.00000
Mn5 Mn 0.26934 0.21560 0.28705 1.00000
Mn6 Mn 0.26923 0.65251 0.43358 1.00000
Mn7 Mn 0.26938 0.42002 0.68113 1.00000
Mn8 Mn 0.26928 0.20651 0.89288 1.00000
Si1 Si 0.76917 0.06980 0.03127 1.00000
Si2 Si 0.26905 0.59770 0.06498 1.00000
Si3 Si 0.76926 0.55227 0.56886 1.00000
Si4 Si 0.26924 0.00627 0.49143 1.00000
Rh1 Rh 0.26907 0.82138 0.89194 1.00000
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