Pr3HoRh3
Alexandria ALEXAlex-ID: agm003545774 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C3_288_spg12
Pr3Rh2 HoRh
2022-04-04 05:46:56.672873
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003545774).
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 agm003545774
data_agm003545774
_cell_length_a 7.04813
_cell_length_b 7.04813
_cell_length_c 7.20171
_cell_angle_alpha 90.48666
_cell_angle_beta 90.48666
_cell_angle_gamma 96.78602
_cell_volume 355.21734
_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
Pr1 Pr 0.66706 0.66706 0.37400 1.00000
Pr2 Pr 0.17945 0.82055 0.50000 1.00000
Pr3 Pr 0.82055 0.17945 0.50000 1.00000
Pr4 Pr 0.25261 0.74739 0.00000 1.00000
Pr5 Pr 0.74739 0.25261 0.00000 1.00000
Pr6 Pr 0.33294 0.33294 0.62600 1.00000
Ho1 Ho 0.76306 0.76306 0.87120 1.00000
Ho2 Ho 0.23694 0.23694 0.12880 1.00000
Rh1 Rh 0.93514 0.93514 0.19352 1.00000
Rh2 Rh 0.98633 0.50264 0.72428 1.00000
Rh3 Rh 0.50264 0.98633 0.72428 1.00000
Rh4 Rh 0.01367 0.49736 0.27572 1.00000
Rh5 Rh 0.49736 0.01367 0.27572 1.00000
Rh6 Rh 0.06486 0.06486 0.80648 1.00000
Get direct link