Ag2PdIO4
Alexandria ALEXAlex-ID: agm004785698 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_755_spg1
AgPdO2 AgIO3 AgI
2022-07-19 00:57:32.504937
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004785698).
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 agm004785698
data_agm004785698
_cell_length_a 6.40748
_cell_length_b 5.36195
_cell_length_c 5.68881
_cell_angle_alpha 106.08405
_cell_angle_beta 125.87387
_cell_angle_gamma 103.95047
_cell_volume 130.15209
_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
Ag1 Ag 0.45013 0.93054 0.91368 1.00000
Ag2 Ag 0.29193 0.27859 0.53145 1.00000
Pd1 Pd 0.08101 0.60677 0.23040 1.00000
I1 I 0.81187 0.79215 0.55401 1.00000
O1 O 0.70562 0.51520 0.68628 1.00000
O2 O 0.73664 0.47577 0.20509 1.00000
O3 O 0.41154 0.72150 0.23954 1.00000
O4 O 0.89832 0.06652 0.41366 1.00000
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