HoBi2H7
Alexandria ALEXAlex-ID: agm006209151 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_612_spg2
BiH2 HoH3
2024-02-01 08:50:55
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006209151).
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 agm006209151
data_agm006209151
_cell_length_a 5.27336
_cell_length_b 7.33284
_cell_length_c 7.66174
_cell_angle_alpha 151.53923
_cell_angle_beta 71.66124
_cell_angle_gamma 108.44465
_cell_volume 133.49946
_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
H1 H 0.08601 0.98177 0.39907 1.00000
H2 H 0.95510 0.76093 0.51620 1.00000
H3 H 0.33815 0.42482 0.95462 1.00000
H4 H 0.06410 0.15290 0.19124 1.00000
H5 H 0.65854 0.87510 0.46319 1.00000
H6 H 0.58677 0.23309 0.10773 1.00000
H7 H 0.81405 0.53791 0.86043 1.00000
Bi1 Bi 0.31346 0.80538 0.77552 1.00000
Bi2 Bi 0.51139 0.91496 0.23601 1.00000
Ho1 Ho 0.90483 0.37054 0.96416 1.00000
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