Ac2Pt3O8
Alexandria ALEXAlex-ID: agm005646427 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C8_351_spg12
Ac5(PtO6)2 Ac4Pt6O19 Pt
2023-06-16 04:05:20.590897
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005646427).
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 agm005646427
data_agm005646427
_cell_length_a 6.16723
_cell_length_b 6.28722
_cell_length_c 6.20886
_cell_angle_alpha 120.41838
_cell_angle_beta 105.98953
_cell_angle_gamma 90.00001
_cell_volume 196.73179
_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
Ac1 Ac 0.34026 0.29969 0.59937 1.00000
Ac2 Ac 0.65974 0.70031 0.40063 1.00000
Pt1 Pt 0.50000 0.00000 0.00000 1.00000
Pt2 Pt 1.00000 0.24818 0.00000 1.00000
Pt3 Pt 0.00000 0.75182 1.00000 1.00000
O1 O 0.98445 0.61806 0.23613 1.00000
O2 O 0.01555 0.38194 0.76387 1.00000
O3 O 0.98371 0.11773 0.23546 1.00000
O4 O 0.01629 0.88227 0.76454 1.00000
O5 O 0.64412 0.68190 0.82719 1.00000
O6 O 0.64412 0.14529 0.82719 1.00000
O7 O 0.35588 0.85471 0.17281 1.00000
O8 O 0.35588 0.31810 0.17281 1.00000
Get direct link