SiH8PdPt2
Alexandria ALEXAlex-ID: agm007752887 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_1059_spg12
H4Pd SiH20 H3Pt SiPt2
2024-02-10 18:25:58
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007752887).
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 agm007752887
data_agm007752887
_cell_length_a 4.19633
_cell_length_b 4.58569
_cell_length_c 6.77632
_cell_angle_alpha 95.02511
_cell_angle_beta 83.02249
_cell_angle_gamma 123.00802
_cell_volume 108.50461
_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
Si1 Si 0.00000 0.00000 0.50000 1.00000
H1 H 0.76072 0.55266 0.41024 1.00000
H2 H 0.58597 0.78594 0.86110 1.00000
H3 H 0.23928 0.44734 0.58976 1.00000
H4 H 0.01907 0.64611 0.86398 1.00000
H5 H 0.98093 0.35389 0.13602 1.00000
H6 H 0.44081 0.21128 0.81622 1.00000
H7 H 0.55919 0.78872 0.18378 1.00000
H8 H 0.41403 0.21406 0.13890 1.00000
Pd1 Pd 0.00000 0.00000 0.00000 1.00000
Pt1 Pt 0.37921 0.85308 0.68791 1.00000
Pt2 Pt 0.62079 0.14692 0.31209 1.00000
Get direct link