Cr2Fe3Rh4
Alexandria ALEXAlex-ID: agm005668155 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_845_spg12
Cr2FeRh5 Cr2FeRh3 Fe
2023-06-26 23:46:47.737260
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005668155).
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 agm005668155
data_agm005668155
_cell_length_a 2.70223
_cell_length_b 4.53936
_cell_length_c 11.07221
_cell_angle_alpha 67.34134
_cell_angle_beta 89.99998
_cell_angle_gamma 72.68384
_cell_volume 118.63479
_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
Cr1 Cr 0.33460 0.33079 0.77570 1.00000
Cr2 Cr 0.66540 0.66921 0.22430 1.00000
Fe1 Fe 0.33010 0.33981 0.44460 1.00000
Fe2 Fe 0.00000 0.00000 0.00000 1.00000
Fe3 Fe 0.66990 0.66019 0.55540 1.00000
Rh1 Rh 0.66832 0.66335 0.88805 1.00000
Rh2 Rh 0.00481 0.99039 0.33828 1.00000
Rh3 Rh 0.99519 0.00961 0.66172 1.00000
Rh4 Rh 0.33168 0.33665 0.11195 1.00000
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