SrLi2AgH6
Alexandria ALEXAlex-ID: agm094770108 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D6_659_spg1
SrLiH3 LiH9 LiH Ag
2025-05-27 02:39:59
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm094770108).
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 agm094770108
data_agm094770108
_cell_length_a 5.70587
_cell_length_b 4.89795
_cell_length_c 6.16036
_cell_angle_alpha 60.48124
_cell_angle_beta 50.21872
_cell_angle_gamma 60.34323
_cell_volume 110.90563
_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
Sr1 Sr 0.53938 0.53821 0.39112 1.00000
Li1 Li 0.98945 0.06409 0.76459 1.00000
Li2 Li 0.27927 0.34215 0.11866 1.00000
Ag1 Ag 0.73529 0.76819 0.68366 1.00000
H1 H 0.98468 0.50689 0.45102 1.00000
H2 H 0.45367 0.00964 0.52655 1.00000
H3 H 0.01315 0.03416 0.43797 1.00000
H4 H 0.65241 0.39683 0.97911 1.00000
H5 H 0.53918 0.99947 0.93396 1.00000
H6 H 0.07453 0.60136 0.93036 1.00000
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