Mn4Fe3GeRh8
Alexandria ALEXAlex-ID: agm047157264 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C4D8_28_spg166
Fe4Rh3 FeRh3 MnRh Mn2GeRh3
2024-11-11 08:55:12.943271
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm047157264).
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 agm047157264
data_agm047157264
_cell_length_a 14.25391
_cell_length_b 14.25391
_cell_length_c 14.25391
_cell_angle_alpha 17.32282
_cell_angle_beta 17.32282
_cell_angle_gamma 17.32282
_cell_volume 224.05062
_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 0.37505 0.37505 0.37505 1.00000
Mn2 Mn 0.62495 0.62495 0.62495 1.00000
Mn3 Mn 0.12449 0.12449 0.12449 1.00000
Mn4 Mn 0.87551 0.87551 0.87551 1.00000
Fe1 Fe 0.25042 0.25042 0.25042 1.00000
Fe2 Fe 0.00000 0.00000 0.00000 1.00000
Fe3 Fe 0.74958 0.74958 0.74958 1.00000
Ge1 Ge 0.50000 0.50000 0.50000 1.00000
Rh1 Rh 0.06265 0.06265 0.06265 1.00000
Rh2 Rh 0.31251 0.31251 0.31251 1.00000
Rh3 Rh 0.81265 0.81265 0.81265 1.00000
Rh4 Rh 0.56238 0.56238 0.56238 1.00000
Rh5 Rh 0.43762 0.43762 0.43762 1.00000
Rh6 Rh 0.68749 0.68749 0.68749 1.00000
Rh7 Rh 0.18735 0.18735 0.18735 1.00000
Rh8 Rh 0.93735 0.93735 0.93735 1.00000
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