PrHo(H3Os)2
Alexandria ALEXAlex-ID: agm007709276 · Space group: C2/c (#15)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_420_spg15
Pr4H9 HoH3 PrH5Os Os
2024-03-05 17:57:58.345371
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007709276).
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 agm007709276
data_agm007709276
_cell_length_a 6.15606
_cell_length_b 6.15606
_cell_length_c 6.41628
_cell_angle_alpha 77.55738
_cell_angle_beta 77.55738
_cell_angle_gamma 104.54689
_cell_volume 220.28867
_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 0.84568 0.15432 0.25000 1.00000
Pr2 Pr 0.15432 0.84568 0.75000 1.00000
Ho1 Ho 0.43003 0.56997 0.25000 1.00000
Ho2 Ho 0.56997 0.43003 0.75000 1.00000
H1 H 0.45080 0.90422 0.36758 1.00000
H2 H 0.09578 0.54920 0.13242 1.00000
H3 H 0.54920 0.09578 0.63242 1.00000
H4 H 0.90422 0.45080 0.86758 1.00000
H5 H 0.15456 0.21633 0.46318 1.00000
H6 H 0.78367 0.84544 0.03682 1.00000
H7 H 0.84544 0.78367 0.53682 1.00000
H8 H 0.21633 0.15456 0.96318 1.00000
H9 H 0.53751 0.30178 0.11602 1.00000
H10 H 0.69822 0.46249 0.38398 1.00000
H11 H 0.46249 0.69822 0.88398 1.00000
H12 H 0.30178 0.53751 0.61602 1.00000
Os1 Os 0.01997 0.32614 0.66635 1.00000
Os2 Os 0.67386 0.98003 0.83365 1.00000
Os3 Os 0.98003 0.67386 0.33365 1.00000
Os4 Os 0.32614 0.01997 0.16635 1.00000
Get direct link