SrCdH7Au2
Alexandria ALEXAlex-ID: agm006751975 · Space group: I-4m2 (#119)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D7_239_spg119
Sr(CdAu2)2 Sr2(H2Au)3 CdH4 H6Au
2025-04-28 18:10:07
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006751975).
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 agm006751975
data_agm006751975
_cell_length_a 3.95243
_cell_length_b 3.95243
_cell_length_c 8.87262
_cell_angle_alpha 77.21780
_cell_angle_beta 102.78220
_cell_angle_gamma 90.04842
_cell_volume 131.65239
_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 0.50123 0.50123 0.00000 1.00000
Cd1 Cd 0.24897 0.24897 0.50000 1.00000
H1 H 0.39914 0.10392 0.79416 1.00000
H2 H 0.00156 0.00156 0.00000 1.00000
H3 H 0.10392 0.39914 0.20584 1.00000
H4 H 0.21885 0.77687 0.44295 1.00000
H5 H 0.89685 0.60492 0.79025 1.00000
H6 H 0.77687 0.21885 0.55705 1.00000
H7 H 0.60492 0.89685 0.20975 1.00000
Au1 Au 0.11227 0.88896 0.22309 1.00000
Au2 Au 0.88896 0.11227 0.77691 1.00000
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