SrH4OsPd2
Alexandria ALEXAlex-ID: agm007107673 · Space group: C2 (#5)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_733_spg42
Sr2H3Pd17 HPd Sr2H6Os Os
2024-03-26 03:49:30.794290
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007107673).
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 agm007107673
data_agm007107673
_cell_length_a 4.65758
_cell_length_b 4.65758
_cell_length_c 5.84038
_cell_angle_alpha 67.97038
_cell_angle_beta 67.97038
_cell_angle_gamma 60.33569
_cell_volume 99.19031
_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 0.77563 0.22437 0.00000 1.00000
H1 H 0.22742 0.10020 0.24329 1.00000
H2 H 0.25253 0.67066 0.23707 1.00000
H3 H 0.89980 0.77258 0.75671 1.00000
H4 H 0.32934 0.74747 0.76293 1.00000
Os1 Os 0.22751 0.77249 0.50000 1.00000
Pd1 Pd 0.91022 0.46530 0.42127 1.00000
Pd2 Pd 0.53470 0.08978 0.57873 1.00000
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