Pm2SnHg2
Alexandria ALEXAlex-ID: agm003397604 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C2_497_spg12
PmHg2 PmSn
2022-02-12 00:32:52.974460
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003397604).
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 agm003397604
data_agm003397604
_cell_length_a 4.65182
_cell_length_b 6.24254
_cell_length_c 10.56655
_cell_angle_alpha 90.27838
_cell_angle_beta 77.28391
_cell_angle_gamma 68.12455
_cell_volume 276.48401
_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 0.67685 0.31626 0.33004 1.00000
Pm2 Pm 0.91766 0.26243 0.90224 1.00000
Pm3 Pm 0.32315 0.68374 0.66996 1.00000
Pm4 Pm 0.08234 0.73757 0.09776 1.00000
Sn1 Sn 0.59946 0.11598 0.68509 1.00000
Sn2 Sn 0.40054 0.88402 0.31491 1.00000
Hg1 Hg 0.09362 0.26526 0.54749 1.00000
Hg2 Hg 0.65645 0.79641 0.89069 1.00000
Hg3 Hg 0.90638 0.73474 0.45251 1.00000
Hg4 Hg 0.34355 0.20359 0.10931 1.00000
Get direct link