Ce2(HPt)5
Alexandria ALEXAlex-ID: agm005656610 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B5C5_156_spg10
Ce(HPt)3 CeH3Pt CePt3
2023-06-20 16:30:05.005905
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005656610).
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 agm005656610
data_agm005656610
_cell_length_a 5.04412
_cell_length_b 4.68133
_cell_length_c 7.57113
_cell_angle_alpha 89.99921
_cell_angle_beta 90.00174
_cell_angle_gamma 105.20035
_cell_volume 172.52390
_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 0.00000 0.50000 0.00000 1.00000
Ce2 Ce 0.00000 1.00000 0.50000 1.00000
H1 H 0.00001 0.50000 0.44690 1.00000
H2 H 1.00000 0.00000 0.82791 1.00000
H3 H 0.00000 1.00000 0.17209 1.00000
H4 H 0.99999 0.50000 0.55310 1.00000
H5 H 0.50000 0.00000 0.00000 1.00000
Pt1 Pt 0.50000 0.50000 0.50000 1.00000
Pt2 Pt 0.64715 0.78788 0.19084 1.00000
Pt3 Pt 0.35284 0.21212 0.80916 1.00000
Pt4 Pt 0.35285 0.21212 0.19084 1.00000
Pt5 Pt 0.64715 0.78788 0.80916 1.00000
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