SrH8PdPt2
Alexandria ALEXAlex-ID: agm007406984 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_331_spg12
SrH6Pt H3Pt Pt HPd
2024-04-17 19:47:50.590676
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007406984).
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 agm007406984
data_agm007406984
_cell_length_a 4.58187
_cell_length_b 4.73145
_cell_length_c 7.78061
_cell_angle_alpha 66.20993
_cell_angle_beta 72.89719
_cell_angle_gamma 61.07399
_cell_volume 134.05202
_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 0.69993 0.12603 0.50350 1.00000
H1 H 0.16397 0.54246 0.66473 1.00000
H2 H 0.65755 0.54263 0.66456 1.00000
H3 H 0.23590 0.70959 0.34228 1.00000
H4 H 0.87789 0.91157 0.86825 1.00000
H5 H 0.52201 0.34059 0.13874 1.00000
H6 H 0.37220 0.91160 0.86803 1.00000
H7 H 0.02765 0.34055 0.13894 1.00000
H8 H 0.74230 0.70940 0.34245 1.00000
Pd1 Pd 0.69994 0.62610 0.00347 1.00000
Pt1 Pt 0.28863 0.67106 0.78084 1.00000
Pt2 Pt 0.11124 0.58108 0.22613 1.00000
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