Er9LuHf2
Alexandria ALEXAlex-ID: agm101930757 · Space group: P6/mmm (#191)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C9_107_spg65
Er3Lu Er Hf
2025-05-19 10:58:34
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm101930757).
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 agm101930757
data_agm101930757
_cell_length_a 10.88629
_cell_length_b 10.88629
_cell_length_c 3.40808
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 120.00705
_cell_volume 349.75960
_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
Er1 Er 0.18244 0.81756 0.50000 1.00000
Er2 Er 0.00000 0.50000 0.00000 1.00000
Er3 Er 0.50000 0.50000 0.00000 1.00000
Er4 Er 0.18249 0.36488 0.50000 1.00000
Er5 Er 0.81756 0.18244 0.50000 1.00000
Er6 Er 0.36488 0.18249 0.50000 1.00000
Er7 Er 0.81751 0.63512 0.50000 1.00000
Er8 Er 0.50000 0.00000 0.00000 1.00000
Er9 Er 0.63512 0.81751 0.50000 1.00000
Lu1 Lu 0.00000 0.00000 0.00000 1.00000
Hf1 Hf 0.33336 0.66664 0.00000 1.00000
Hf2 Hf 0.66664 0.33336 0.00000 1.00000
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