Pm2Pr4Er
Alexandria ALEXAlex-ID: agm024168900 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_176_spg12
Pm2PrEr6 Pm2Pr Pr
2025-04-19 01:04:14
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024168900).
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 agm024168900
data_agm024168900
_cell_length_a 6.34830
_cell_length_b 6.34830
_cell_length_c 8.19075
_cell_angle_alpha 82.60107
_cell_angle_beta 97.39893
_cell_angle_gamma 131.69977
_cell_volume 243.99557
_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 0.28553 0.71447 0.36033 1.00000
Pm2 Pm 0.71447 0.28553 0.63967 1.00000
Pr1 Pr 0.85676 0.14324 0.07425 1.00000
Pr2 Pr 0.14324 0.85676 0.92575 1.00000
Pr3 Pr 0.42926 0.57074 0.78226 1.00000
Pr4 Pr 0.57074 0.42926 0.21774 1.00000
Er1 Er 0.00000 0.00000 0.50000 1.00000
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