Ho(SiH3)2
Alexandria ALEXAlex-ID: agm097595779 · Space group: C2 (#5)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_299_spg2
SiH4 HoH3 Si
2025-04-29 17:47:23
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097595779).
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 agm097595779
data_agm097595779
_cell_length_a 3.77200
_cell_length_b 3.77297
_cell_length_c 7.11478
_cell_angle_alpha 87.04673
_cell_angle_beta 92.97350
_cell_angle_gamma 114.49433
_cell_volume 91.96807
_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 0.70206 0.70248 0.24983 1.00000
Si1 Si 0.12950 0.10546 0.93575 1.00000
Si2 Si 0.10563 0.12918 0.56414 1.00000
H1 H 0.49604 0.49040 0.93975 1.00000
H2 H 0.49037 0.49591 0.56017 1.00000
H3 H 0.02970 0.34463 0.22929 1.00000
H4 H 0.93506 0.26696 0.74709 1.00000
H5 H 0.34434 0.03004 0.27122 1.00000
H6 H 0.26731 0.93494 0.75277 1.00000
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