Sr3(Si2Pd)2
Alexandria ALEXAlex-ID: agm005656013 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_300_spg12
SrSiPd Sr2Si3Pd
2023-06-28 08:42:39.677254
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005656013).
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 agm005656013
data_agm005656013
_cell_length_a 4.01656
_cell_length_b 6.35643
_cell_length_c 8.82867
_cell_angle_alpha 95.68113
_cell_angle_beta 90.00003
_cell_angle_gamma 108.41782
_cell_volume 212.69143
_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 0.66903 0.33806 0.66633 1.00000
Sr2 Sr 0.00000 0.00000 0.00000 1.00000
Sr3 Sr 0.33097 0.66194 0.33367 1.00000
Si1 Si 0.72014 0.44028 0.06055 1.00000
Si2 Si 0.27986 0.55972 0.93945 1.00000
Si3 Si 0.94859 0.89719 0.60860 1.00000
Si4 Si 0.05141 0.10281 0.39140 1.00000
Pd1 Pd 0.60890 0.21779 0.27754 1.00000
Pd2 Pd 0.39110 0.78221 0.72246 1.00000
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