PrHo(AsO4)2
Alexandria ALEXAlex-ID: agm004889023 · Space group: I-4 (#82)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_848_spg82
HoAsO4 PrAsO4
2023-01-01 22:25:10.238586
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004889023).
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 agm004889023
data_agm004889023
_cell_length_a 5.11561
_cell_length_b 5.11561
_cell_length_c 6.82284
_cell_angle_alpha 112.01746
_cell_angle_beta 112.01746
_cell_angle_gamma 90.00000
_cell_volume 151.39088
_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 0.75000 0.25000 0.50000 1.00000
Ho1 Ho 0.00000 0.00000 0.00000 1.00000
As1 As 0.50000 0.50000 0.00000 1.00000
As2 As 0.25000 0.75000 0.50000 1.00000
O1 O 0.72625 0.82546 0.15114 1.00000
O2 O 0.42489 0.32568 0.15114 1.00000
O3 O 0.58106 0.69494 0.66110 1.00000
O4 O 0.08004 0.96616 0.66110 1.00000
O5 O 0.03384 0.41894 0.33890 1.00000
O6 O 0.30506 0.91996 0.33890 1.00000
O7 O 0.17454 0.57511 0.84886 1.00000
O8 O 0.67432 0.27375 0.84886 1.00000
Get direct link