Pr2Nd2DyHg2
Alexandria ALEXAlex-ID: agm025487683 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_14_spg12
Nd2Hg Pr2Hg Dy2Hg Pr
2025-04-18 22:30:51
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm025487683).
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 agm025487683
data_agm025487683
_cell_length_a 6.79131
_cell_length_b 6.79131
_cell_length_c 8.89132
_cell_angle_alpha 81.67555
_cell_angle_beta 98.32445
_cell_angle_gamma 147.59844
_cell_volume 217.23216
_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 0.25725 0.74275 0.83236 1.00000
Pr2 Pr 0.74275 0.25725 0.16764 1.00000
Nd1 Nd 0.87497 0.12503 0.54950 1.00000
Nd2 Nd 0.12503 0.87497 0.45050 1.00000
Dy1 Dy 0.00000 0.00000 0.00000 1.00000
Hg1 Hg 0.45117 0.54883 0.25536 1.00000
Hg2 Hg 0.54883 0.45117 0.74464 1.00000
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