Y4AlH8
Alexandria ALEXAlex-ID: agm097758136 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_402_spg12
YH3 YAl3 YH2
2025-06-16 00:50:27
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097758136).
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
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm097758136
data_agm097758136
_cell_length_a 3.75066
_cell_length_b 7.65816
_cell_length_c 7.53443
_cell_angle_alpha 128.92512
_cell_angle_beta 83.27997
_cell_angle_gamma 101.95727
_cell_volume 164.68435
_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
Y1 Y 0.87216 0.98428 0.97689 1.00000
Y2 Y 0.79419 0.96287 0.47589 1.00000
Y3 Y 0.13180 0.56374 0.46020 1.00000
Y4 Y 0.27683 0.51086 0.93719 1.00000
Al1 Al 0.43162 0.21822 0.40506 1.00000
H1 H 0.21889 0.96933 0.68710 1.00000
H2 H 0.91526 0.18477 0.34760 1.00000
H3 H 0.24071 0.73577 0.31114 1.00000
H4 H 0.27805 0.75006 0.83812 1.00000
H5 H 0.10128 0.32812 0.09111 1.00000
H6 H 0.74171 0.29825 0.80907 1.00000
H7 H 0.68086 0.74921 0.58139 1.00000
H8 H 0.81662 0.74451 0.07923 1.00000
Get direct link