Dy6HgRh3
Alexandria ALEXAlex-ID: agm005992090 · Space group: P2_1/m (#11)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C6_257_spg11
Dy5Rh3 DyHg
2023-09-20 23:23:44
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005992090).
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 agm005992090
data_agm005992090
_cell_length_a 4.10308
_cell_length_b 11.63639
_cell_length_c 11.70470
_cell_angle_alpha 108.77298
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 529.11144
_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
Dy1 Dy 0.75000 0.46032 0.59393 1.00000
Dy2 Dy 0.25000 0.53968 0.40607 1.00000
Dy3 Dy 0.75000 0.94387 0.10507 1.00000
Dy4 Dy 0.25000 0.05613 0.89493 1.00000
Dy5 Dy 0.75000 0.38596 0.02979 1.00000
Dy6 Dy 0.25000 0.61404 0.97021 1.00000
Dy7 Dy 0.75000 0.69938 0.26891 1.00000
Dy8 Dy 0.25000 0.30062 0.73109 1.00000
Dy9 Dy 0.75000 0.13711 0.44599 1.00000
Dy10 Dy 0.25000 0.86289 0.55401 1.00000
Dy11 Dy 0.75000 0.75603 0.78326 1.00000
Dy12 Dy 0.25000 0.24397 0.21674 1.00000
Hg1 Hg 0.75000 0.07367 0.69422 1.00000
Hg2 Hg 0.25000 0.92633 0.30578 1.00000
Rh1 Rh 0.75000 0.47392 0.82938 1.00000
Rh2 Rh 0.25000 0.52608 0.17062 1.00000
Rh3 Rh 0.75000 0.69144 0.52082 1.00000
Rh4 Rh 0.25000 0.30856 0.47918 1.00000
Rh5 Rh 0.75000 0.15904 0.05619 1.00000
Rh6 Rh 0.25000 0.84096 0.94381 1.00000
