Sm2Dy2ErHg2
Alexandria ALEXAlex-ID: agm023935558 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_14_spg12
DyErHg Sm2Hg Dy2Hg Sm
2025-06-27 17:56:04
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm023935558).
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 agm023935558
data_agm023935558
_cell_length_a 6.68368
_cell_length_b 6.68368
_cell_length_c 8.61636
_cell_angle_alpha 81.20071
_cell_angle_beta 98.79929
_cell_angle_gamma 147.79127
_cell_volume 202.53984
_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
Sm1 Sm 0.25607 0.74393 0.83156 1.00000
Sm2 Sm 0.74393 0.25607 0.16844 1.00000
Dy1 Dy 0.87205 0.12795 0.55401 1.00000
Dy2 Dy 0.12795 0.87205 0.44599 1.00000
Er1 Er 0.00000 0.00000 0.00000 1.00000
Hg1 Hg 0.45133 0.54867 0.26470 1.00000
Hg2 Hg 0.54867 0.45133 0.73530 1.00000
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