Pm6Dy3Pu
Alexandria ALEXAlex-ID: agm006013463 · Space group: P2_1/c (#14)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C6_1232_spg58
Pm3Dy5 Pm Pu
2023-09-20 06:24:56
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006013463).
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 agm006013463
data_agm006013463
_cell_length_a 6.16700
_cell_length_b 9.34795
_cell_length_c 11.52229
_cell_angle_alpha 90.00000
_cell_angle_beta 89.08953
_cell_angle_gamma 90.00000
_cell_volume 664.16221
_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 0.48620 0.84102 0.93044 1.00000
Pm2 Pm 0.49401 0.83638 0.57135 1.00000
Pm3 Pm 0.36030 0.48172 0.25661 1.00000
Pm4 Pm 0.63970 0.51828 0.74339 1.00000
Pm5 Pm 0.50599 0.16362 0.42865 1.00000
Pm6 Pm 0.51380 0.15898 0.06956 1.00000
Pm7 Pm 0.98620 0.65898 0.43044 1.00000
Pm8 Pm 0.99401 0.66362 0.07135 1.00000
Pm9 Pm 0.86030 0.01828 0.75661 1.00000
Pm10 Pm 0.13970 0.98172 0.24339 1.00000
Pm11 Pm 0.00599 0.33638 0.92865 1.00000
Pm12 Pm 0.01380 0.34102 0.56956 1.00000
Dy1 Dy 0.37762 0.16654 0.74919 1.00000
Dy2 Dy 0.50000 0.50000 0.00000 1.00000
Dy3 Dy 0.62238 0.83346 0.25081 1.00000
Dy4 Dy 0.87762 0.33346 0.24919 1.00000
Dy5 Dy 0.00000 0.00000 0.50000 1.00000
Dy6 Dy 0.12238 0.66654 0.75081 1.00000
Pu1 Pu 0.50000 0.50000 0.50000 1.00000
Pu2 Pu 0.00000 0.00000 0.00000 1.00000
