CeH8Pt2Pb
Alexandria ALEXAlex-ID: agm007453017 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_869_spg12
CeH6Pt Ce(HPt)3 H6Pb PtPb4
2024-03-05 21:44:37.883779
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007453017).
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 agm007453017
data_agm007453017
_cell_length_a 4.62865
_cell_length_b 4.68637
_cell_length_c 7.91863
_cell_angle_alpha 92.10029
_cell_angle_beta 101.23332
_cell_angle_gamma 124.30839
_cell_volume 136.87195
_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 0.50000 1.00000
H1 H 0.32918 0.69361 0.05149 1.00000
H2 H 0.35563 0.96953 0.30410 1.00000
H3 H 0.67082 0.30639 0.94851 1.00000
H4 H 0.64437 0.03047 0.69590 1.00000
H5 H 0.33166 0.48729 0.78903 1.00000
H6 H 0.66834 0.51271 0.21097 1.00000
H7 H 0.31208 0.19349 0.52484 1.00000
H8 H 0.68792 0.80651 0.47516 1.00000
Pt1 Pt 0.48562 0.25671 0.74009 1.00000
Pt2 Pt 0.51438 0.74329 0.25991 1.00000
Pb1 Pb 0.00000 0.00000 0.00000 1.00000
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