TmBiH6
Alexandria ALEXAlex-ID: agm076089188 · Space group: Pm (#6)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC6_2202_spg156
BiH2 BiH9 TmH3
2025-06-26 23:41:42
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm076089188).
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 agm076089188
data_agm076089188
_cell_length_a 3.67609
_cell_length_b 7.69388
_cell_length_c 3.76869
_cell_angle_alpha 77.14001
_cell_angle_beta 62.25378
_cell_angle_gamma 61.48100
_cell_volume 82.88858
_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
Tm1 Tm 0.30366 0.21882 0.98423 1.00000
Bi1 Bi 0.07567 0.71847 0.16137 1.00000
H1 H 0.99133 0.54073 0.92233 1.00000
H2 H 0.79397 0.07191 0.28079 1.00000
H3 H 0.47584 0.71786 0.56905 1.00000
H4 H 0.63496 0.89673 0.92326 1.00000
H5 H 0.50034 0.36626 0.27916 1.00000
H6 H 0.97423 0.21923 0.62981 1.00000
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