Pm2PrHo4
Alexandria ALEXAlex-ID: agm005874595 · Space group: R3m (#160)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_847_spg8
Pm2Ho7 Pm2Pr Pr
2023-10-19 17:53:43
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005874595).
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 agm005874595
data_agm005874595
_cell_length_a 3.62961
_cell_length_b 3.62818
_cell_length_c 20.31720
_cell_angle_alpha 95.14963
_cell_angle_beta 89.99999
_cell_angle_gamma 120.01303
_cell_volume 230.43060
_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
Pm1 Pm 0.61979 0.23958 0.09462 1.00000
Pm2 Pm 0.71323 0.42646 0.38020 1.00000
Pr1 Pr 0.80957 0.61915 0.66798 1.00000
Ho1 Ho 0.90585 0.81170 0.95123 1.00000
Ho2 Ho 0.42697 0.85393 0.52211 1.00000
Ho3 Ho 0.00004 0.00008 0.23794 1.00000
Ho4 Ho 0.52595 0.05191 0.81391 1.00000
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