Al2AgH8Pb
Alexandria ALEXAlex-ID: agm007573239 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_589_spg2
AlAg4 AlH3 Pb H6Pb
2024-02-09 02:11:17
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007573239).
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 agm007573239
data_agm007573239
_cell_length_a 5.07004
_cell_length_b 6.73627
_cell_length_c 6.60531
_cell_angle_alpha 105.02842
_cell_angle_beta 120.23057
_cell_angle_gamma 109.84414
_cell_volume 155.54449
_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
Al1 Al 0.69560 0.32410 0.12208 1.00000
Al2 Al 0.30440 0.67590 0.87792 1.00000
Ag1 Ag 0.00000 0.00000 0.00000 1.00000
H1 H 0.94934 0.38273 0.65718 1.00000
H2 H 0.50106 0.73796 0.19457 1.00000
H3 H 0.05066 0.61727 0.34282 1.00000
H4 H 0.49894 0.26204 0.80543 1.00000
H5 H 0.85215 0.15434 0.20463 1.00000
H6 H 0.14785 0.84566 0.79537 1.00000
H7 H 0.38689 0.31140 0.16138 1.00000
H8 H 0.61311 0.68860 0.83862 1.00000
Pb1 Pb 0.50000 0.00000 0.50000 1.00000
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