HoGa2H7
Alexandria ALEXAlex-ID: agm006201225 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C7_811_spg12
HoH11 HoH3 Ga
2023-11-18 09:19:56
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006201225).
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 agm006201225
data_agm006201225
_cell_length_a 6.19695
_cell_length_b 6.19781
_cell_length_c 5.98646
_cell_angle_alpha 138.65624
_cell_angle_beta 41.33506
_cell_angle_gamma 120.42263
_cell_volume 99.44258
_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 0.01195 0.92320 0.32356 1.00000
H2 H 0.91789 0.79663 0.64485 1.00000
H3 H 0.53208 0.41182 0.64586 1.00000
H4 H 0.10307 0.22441 0.11403 1.00000
H5 H 0.56965 0.75931 0.54077 1.00000
H6 H 0.40576 0.31714 0.32321 1.00000
H7 H 0.80439 0.52507 0.89725 1.00000
Ho1 Ho 0.02207 0.30708 0.89610 1.00000
Ga1 Ga 0.28824 0.04049 0.03099 1.00000
Ga2 Ga 0.57729 0.75224 0.05154 1.00000
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