Ho6Tl2CoH
Alexandria ALEXAlex-ID: agm007451685 · Space group: I4/m (#87)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_393_spg12
Ho12TlCo6 Ho2TlH2 Ho8Tl3Co HoH2
2024-03-06 01:21:39.185200
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007451685).
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 agm007451685
data_agm007451685
_cell_length_a 7.09912
_cell_length_b 7.09912
_cell_length_c 7.09912
_cell_angle_alpha 120.90458
_cell_angle_beta 120.90458
_cell_angle_gamma 88.44024
_cell_volume 249.42827
_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 0.21528 0.71106 0.92634 1.00000
Ho2 Ho 0.71106 0.78472 0.49578 1.00000
Ho3 Ho 0.78472 0.28894 0.07366 1.00000
Ho4 Ho 0.75101 0.75101 0.00000 1.00000
Ho5 Ho 0.28894 0.21528 0.50422 1.00000
Ho6 Ho 0.24899 0.24899 0.00000 1.00000
Tl1 Tl 0.25000 0.75000 0.50000 1.00000
Tl2 Tl 0.75000 0.25000 0.50000 1.00000
Co1 Co 0.00000 0.00000 0.00000 1.00000
H1 H 0.50000 0.50000 0.00000 1.00000
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