Cu(AgH2)3
Alexandria ALEXAlex-ID: agm007240476 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C6_2664_spg1
H2 Ag CuH4
2024-08-14 05:05:03.080613
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007240476).
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 agm007240476
data_agm007240476
_cell_length_a 5.32426
_cell_length_b 5.16110
_cell_length_c 5.70957
_cell_angle_alpha 120.17629
_cell_angle_beta 94.98649
_cell_angle_gamma 111.64977
_cell_volume 118.60019
_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
Cu1 Cu 0.82105 0.78689 0.11374 1.00000
Ag1 Ag 0.27814 0.65006 0.03482 1.00000
Ag2 Ag 0.76131 0.27077 0.12923 1.00000
Ag3 Ag 0.35050 0.41605 0.42443 1.00000
H1 H 0.14803 0.95314 0.76292 1.00000
H2 H 0.88675 0.47220 0.91388 1.00000
H3 H 0.97107 0.19397 0.38975 1.00000
H4 H 0.59232 0.58588 0.25829 1.00000
H5 H 0.12444 0.94194 0.62447 1.00000
H6 H 0.56742 0.73409 0.85448 1.00000
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