HoTm5Hg6
Alexandria ALEXAlex-ID: agm064538591 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_53_spg71
HoTm4Hg5 TmHg
2024-11-10 02:20:27.765373
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm064538591).
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 agm064538591
data_agm064538591
_cell_length_a 9.00090
_cell_length_b 9.00090
_cell_length_c 9.00090
_cell_angle_alpha 146.46638
_cell_angle_beta 131.49472
_cell_angle_gamma 60.25684
_cell_volume 298.94077
_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
Ho1 Ho 0.50000 0.00000 0.50000 1.00000
Tm1 Tm 0.33368 0.33368 0.00000 1.00000
Tm2 Tm 0.16687 0.66687 0.50000 1.00000
Tm3 Tm 0.00000 0.00000 0.00000 1.00000
Tm4 Tm 0.83313 0.33313 0.50000 1.00000
Tm5 Tm 0.66632 0.66632 0.00000 1.00000
Hg1 Hg 0.91895 0.16737 0.75158 1.00000
Hg2 Hg 0.41579 0.16737 0.24842 1.00000
Hg3 Hg 0.75323 0.50000 0.25323 1.00000
Hg4 Hg 0.24677 0.50000 0.74677 1.00000
Hg5 Hg 0.58421 0.83263 0.75158 1.00000
Hg6 Hg 0.08105 0.83263 0.24842 1.00000
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