Li2PmH8Pt
Alexandria ALEXAlex-ID: agm004909121 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_311_spg2
Li2H4Pt PmH3 Li2H6Pt
2023-01-01 22:27:31.691038
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004909121).
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 agm004909121
data_agm004909121
_cell_length_a 4.34937
_cell_length_b 4.64835
_cell_length_c 6.37251
_cell_angle_alpha 57.62018
_cell_angle_beta 89.99929
_cell_angle_gamma 89.99983
_cell_volume 108.80371
_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
Li1 Li 0.50001 0.29507 0.74653 1.00000
Li2 Li 0.49999 0.70493 0.25347 1.00000
Pm1 Pm 0.00000 0.00000 0.50000 1.00000
H1 H 0.00005 0.65103 0.29897 1.00000
H2 H 0.73913 0.82632 0.90568 1.00000
H3 H 0.73910 0.17358 0.09438 1.00000
H4 H 0.99995 0.34897 0.70103 1.00000
H5 H 0.26087 0.17368 0.09432 1.00000
H6 H 0.26090 0.82642 0.90562 1.00000
H7 H 0.49999 0.74957 0.53611 1.00000
H8 H 0.50001 0.25043 0.46389 1.00000
Pt1 Pt 0.00000 0.00000 0.00000 1.00000
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