Ce10P8Pt3O10
Alexandria ALEXAlex-ID: agm017415065 · Space group: I4/m (#87)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B8C10D10_0_spg87
Ce7O12 Ce2PO2 P2Pt CePPt
2025-02-05 20:37:29
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm017415065).
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 agm017415065
data_agm017415065
_cell_length_a 8.84691
_cell_length_b 8.84592
_cell_length_c 9.49163
_cell_angle_alpha 117.76865
_cell_angle_beta 117.77873
_cell_angle_gamma 89.99607
_cell_volume 558.71422
_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
Ce1 Ce 0.35327 0.35321 0.70655 1.00000
Ce2 Ce 0.64673 0.64679 0.29345 1.00000
Ce3 Ce 0.73741 0.12400 0.66632 1.00000
Ce4 Ce 0.92888 0.54220 0.66629 1.00000
Ce5 Ce 0.54231 0.73737 0.66633 1.00000
Ce6 Ce 0.12401 0.92888 0.66634 1.00000
Ce7 Ce 0.26259 0.87600 0.33368 1.00000
Ce8 Ce 0.07112 0.45780 0.33371 1.00000
Ce9 Ce 0.45769 0.26263 0.33367 1.00000
Ce10 Ce 0.87599 0.07112 0.33366 1.00000
P1 P 0.12931 0.24765 0.99997 1.00000
P2 P 0.87069 0.75235 0.00003 1.00000
P3 P 0.75235 0.12930 0.00001 1.00000
P4 P 0.24765 0.87070 0.99999 1.00000
P5 P 0.39431 0.26214 0.99997 1.00000
P6 P 0.60569 0.73786 0.00003 1.00000
P7 P 0.73778 0.39424 0.99996 1.00000
P8 P 0.26222 0.60576 0.00004 1.00000
Pt1 Pt 0.00000 0.00000 0.00000 1.00000
Pt2 Pt 0.50000 0.00000 0.00000 1.00000
Pt3 Pt 0.00000 0.50000 0.00000 1.00000
O1 O 0.36031 0.45673 0.51792 1.00000
O2 O 0.15759 0.06118 0.51788 1.00000
O3 O 0.06117 0.36028 0.51788 1.00000
O4 O 0.45671 0.15758 0.51790 1.00000
O5 O 0.63969 0.54327 0.48208 1.00000
O6 O 0.84241 0.93882 0.48212 1.00000
O7 O 0.93883 0.63972 0.48212 1.00000
O8 O 0.54329 0.84242 0.48210 1.00000
O9 O 0.74997 0.24997 0.49994 1.00000
O10 O 0.25003 0.75003 0.50006 1.00000
