V5Ir2Rh5
Alexandria ALEXAlex-ID: agm003374416 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_15_spg12
VIr V3Ir VRh3
2022-02-08 22:16:21.080853
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003374416).
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 agm003374416
data_agm003374416
_cell_length_a 4.31306
_cell_length_b 6.60287
_cell_length_c 7.35644
_cell_angle_alpha 120.15198
_cell_angle_beta 90.00000
_cell_angle_gamma 109.06284
_cell_volume 167.73525
_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
V1 V 0.07641 0.15283 0.37596 1.00000
V2 V 0.76226 0.52453 0.80434 1.00000
V3 V 0.23774 0.47547 0.19566 1.00000
V4 V 0.92359 0.84717 0.62404 1.00000
V5 V 0.00000 0.00000 0.00000 1.00000
Ir1 Ir 0.15523 0.31045 0.77348 1.00000
Ir2 Ir 0.84477 0.68955 0.22652 1.00000
Rh1 Rh 0.50000 0.00000 0.50000 1.00000
Rh2 Rh 0.59028 0.18056 0.92814 1.00000
Rh3 Rh 0.67857 0.35714 0.36357 1.00000
Rh4 Rh 0.32143 0.64286 0.63643 1.00000
Rh5 Rh 0.40972 0.81944 0.07186 1.00000
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