SrSn(H4Pd)2
Alexandria ALEXAlex-ID: agm007448416 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_14_spg1
SrH3Pd SnPd H2
2025-04-28 22:39:29
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007448416).
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 agm007448416
data_agm007448416
_cell_length_a 5.10749
_cell_length_b 4.64052
_cell_length_c 7.08204
_cell_angle_alpha 103.89442
_cell_angle_beta 101.28740
_cell_angle_gamma 115.99558
_cell_volume 137.46815
_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 0.50000 0.00000 0.50000 1.00000
Sn1 Sn 0.00000 0.00000 0.00000 1.00000
H1 H 0.96328 0.40927 0.23969 1.00000
H2 H 0.53066 0.30252 0.89291 1.00000
H3 H 0.03672 0.59073 0.76031 1.00000
H4 H 0.46934 0.69748 0.10709 1.00000
H5 H 0.05854 0.09813 0.56424 1.00000
H6 H 0.94146 0.90187 0.43576 1.00000
H7 H 0.54174 0.63550 0.69526 1.00000
H8 H 0.45826 0.36450 0.30474 1.00000
Pd1 Pd 0.28640 0.44646 0.81453 1.00000
Pd2 Pd 0.71360 0.55354 0.18547 1.00000
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