Y2InP3Rh7
Alexandria ALEXAlex-ID: agm020129862 · Space group: I-4m2 (#119)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D7_53_spg22
Y10P19Rh28 Y6P13Rh20 Y2PRh6 InRh
2024-11-13 11:28:34.632326
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm020129862).
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 agm020129862
data_agm020129862
_cell_length_a 13.47657
_cell_length_b 13.47657
_cell_length_c 13.47657
_cell_angle_alpha 162.80280
_cell_angle_beta 162.80280
_cell_angle_gamma 24.41359
_cell_volume 213.90135
_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
Y1 Y 0.33781 0.33781 0.00000 1.00000
Y2 Y 0.66219 0.66219 0.00000 1.00000
In1 In 0.50000 0.50000 0.00000 1.00000
P1 P 0.12362 0.12362 0.00000 1.00000
P2 P 0.87638 0.87638 0.00000 1.00000
P3 P 0.75000 0.25000 0.50000 1.00000
Rh1 Rh 0.07605 0.57605 0.50000 1.00000
Rh2 Rh 0.57591 0.07591 0.50000 1.00000
Rh3 Rh 0.92409 0.42409 0.50000 1.00000
Rh4 Rh 0.42395 0.92395 0.50000 1.00000
Rh5 Rh 0.21254 0.21254 0.00000 1.00000
Rh6 Rh 0.78746 0.78746 0.00000 1.00000
Rh7 Rh 0.00000 0.00000 0.00000 1.00000
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