Ho2Er2TmHg2
Alexandria ALEXAlex-ID: agm025367992 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2D2_46_spg12
HoEr3Hg2 Ho3ErHg2 ErTm2 HoTmHg
2025-05-02 10:01:09
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm025367992).
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
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# CIF generated by HEAS from Alexandria entry agm025367992
data_agm025367992
_cell_length_a 6.58139
_cell_length_b 6.58139
_cell_length_c 8.47128
_cell_angle_alpha 81.02392
_cell_angle_beta 98.97608
_cell_angle_gamma 147.55038
_cell_volume 194.26303
_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 0.25535 0.74465 0.83428 1.00000
Ho2 Ho 0.74465 0.25535 0.16572 1.00000
Er1 Er 0.87034 0.12966 0.55921 1.00000
Er2 Er 0.12966 0.87034 0.44079 1.00000
Tm1 Tm 0.00000 0.00000 0.00000 1.00000
Hg1 Hg 0.44544 0.55456 0.26666 1.00000
Hg2 Hg 0.55456 0.44544 0.73334 1.00000
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