Rh2C3
Alexandria ALEXAlex-ID: agm005507653 · Space group: Fdd2 (#43)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3_561_spg43
C Rh
2023-03-19 17:20:13.993168
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005507653).
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 agm005507653
data_agm005507653
_cell_length_a 7.25045
_cell_length_b 5.53969
_cell_length_c 5.41204
_cell_angle_alpha 82.90204
_cell_angle_beta 49.30510
_cell_angle_gamma 47.79286
_cell_volume 101.14612
_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
Rh1 Rh 0.14244 0.81896 0.56526 1.00000
Rh2 Rh 0.47334 0.56526 0.81896 1.00000
Rh3 Rh 0.43104 0.10756 0.77666 1.00000
Rh4 Rh 0.68474 0.77666 0.10756 1.00000
C1 C 0.88447 0.34004 0.19123 1.00000
C2 C 0.58427 0.19123 0.34004 1.00000
C3 C 0.90996 0.36553 0.66573 1.00000
C4 C 0.05877 0.66573 0.36553 1.00000
C5 C 0.91548 0.08452 0.08452 1.00000
C6 C 0.16548 0.33452 0.33452 1.00000
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