Lu7Ni2(TeH)2
Alexandria ALEXAlex-ID: agm073031069 · Space group: Imm2 (#44)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B2C2D7_48_spg44
Lu7Ni2(TeH)2
2024-10-29 17:45:54
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm073031069).
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 agm073031069
data_agm073031069
_cell_length_a 9.28586
_cell_length_b 9.28586
_cell_length_c 9.28586
_cell_angle_alpha 156.51026
_cell_angle_beta 120.49400
_cell_angle_gamma 64.87594
_cell_volume 273.05253
_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
Lu1 Lu 0.71956 0.13602 0.58354 1.00000
Lu2 Lu 0.44751 0.86398 0.58354 1.00000
Lu3 Lu 0.70419 0.31881 0.38537 1.00000
Lu4 Lu 0.06656 0.68119 0.38537 1.00000
Lu5 Lu 0.08358 0.34730 0.73629 1.00000
Lu6 Lu 0.38899 0.65270 0.73629 1.00000
Lu7 Lu 0.99786 1.00000 0.99786 1.00000
Ni1 Ni 0.31764 0.24264 0.07500 1.00000
Ni2 Ni 0.83236 0.75736 0.07500 1.00000
Te1 Te 0.33186 0.00000 0.33186 1.00000
Te2 Te 0.72844 0.50000 0.22844 1.00000
H1 H 0.97029 0.42832 0.54197 1.00000
H2 H 0.11365 0.57168 0.54197 1.00000
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