Mn2In2Rh3
Alexandria ALEXAlex-ID: agm009623239 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C3_21_spg12
MnIn2Rh3 Mn
2024-05-29 20:50:15.151196
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm009623239).
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 agm009623239
data_agm009623239
_cell_length_a 7.13167
_cell_length_b 7.13167
_cell_length_c 7.13167
_cell_angle_alpha 36.10156
_cell_angle_beta 36.10156
_cell_angle_gamma 36.10156
_cell_volume 112.65476
_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 0.06553 0.06553 0.06553 1.00000
Mn2 Mn 0.93447 0.93447 0.93447 1.00000
In1 In 0.22071 0.22071 0.22071 1.00000
In2 In 0.77929 0.77929 0.77929 1.00000
Rh1 Rh 0.50000 0.50000 0.50000 1.00000
Rh2 Rh 0.36114 0.36114 0.36114 1.00000
Rh3 Rh 0.63886 0.63886 0.63886 1.00000
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