PmAs(H4Pt)2
Alexandria ALEXAlex-ID: agm007612362 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D8_1512_spg2
PmH5Pt AsH9 Pm(H3Pt)4 As2Pt
2024-02-09 05:29:03
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007612362).
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 agm007612362
data_agm007612362
_cell_length_a 4.53203
_cell_length_b 7.18858
_cell_length_c 6.46350
_cell_angle_alpha 106.30375
_cell_angle_beta 111.24973
_cell_angle_gamma 119.88049
_cell_volume 139.71979
_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
Pm1 Pm 0.50000 0.50000 0.50000 1.00000
As1 As 0.00000 0.00000 0.00000 1.00000
H1 H 0.92059 0.48216 0.37975 1.00000
H2 H 0.74838 0.67635 0.20361 1.00000
H3 H 0.07941 0.51784 0.62025 1.00000
H4 H 0.22693 0.82340 0.98886 1.00000
H5 H 0.77307 0.17660 0.01114 1.00000
H6 H 0.25958 0.64962 0.21379 1.00000
H7 H 0.74042 0.35038 0.78621 1.00000
H8 H 0.25162 0.32365 0.79639 1.00000
Pt1 Pt 0.69897 0.39629 0.06202 1.00000
Pt2 Pt 0.30103 0.60371 0.93798 1.00000
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