Pm3Y6Er2Pu
Alexandria ALEXAlex-ID: agm004634366 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3D6_178_spg12
Pm2Er7 PmY2 YEr5 Pu
2022-07-01 01:35:38.976469
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004634366).
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 agm004634366
data_agm004634366
_cell_length_a 6.18121
_cell_length_b 6.18121
_cell_length_c 11.77653
_cell_angle_alpha 95.02569
_cell_angle_beta 95.02569
_cell_angle_gamma 120.00380
_cell_volume 383.62534
_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 0.16709 0.83291 0.50000 1.00000
Pm2 Pm 0.83291 0.16709 0.50000 1.00000
Pm3 Pm 0.50000 0.50000 0.50000 1.00000
Y1 Y 0.91812 0.58861 0.75510 1.00000
Y2 Y 0.75219 0.75219 0.24489 1.00000
Y3 Y 0.08188 0.41139 0.24490 1.00000
Y4 Y 0.58861 0.91812 0.75510 1.00000
Y5 Y 0.24781 0.24781 0.75511 1.00000
Y6 Y 0.41139 0.08188 0.24490 1.00000
Er1 Er 0.33340 0.66660 0.00000 1.00000
Er2 Er 0.66660 0.33340 0.00000 1.00000
Pu1 Pu 0.00000 0.00000 0.00000 1.00000
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