Na4Sr3Hg4
Alexandria ALEXAlex-ID: agm003379080 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_84_spg71
Sr4Hg3 Na8Hg3 SrHg
2022-02-09 04:46:00.128462
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003379080).
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 agm003379080
data_agm003379080
_cell_length_a 4.55796
_cell_length_b 9.17979
_cell_length_c 10.01631
_cell_angle_alpha 117.27373
_cell_angle_beta 103.15151
_cell_angle_gamma 90.00000
_cell_volume 360.09005
_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
Na1 Na 0.32862 0.14015 0.65725 1.00000
Na2 Na 0.67138 0.48291 0.34275 1.00000
Na3 Na 0.67138 0.85985 0.34275 1.00000
Na4 Na 0.32862 0.51709 0.65725 1.00000
Sr1 Sr 0.11159 0.11159 0.22317 1.00000
Sr2 Sr 0.88841 0.88841 0.77683 1.00000
Sr3 Sr 0.00000 0.50000 0.00000 1.00000
Hg1 Hg 0.24111 0.74111 0.48222 1.00000
Hg2 Hg 0.75889 0.25889 0.51778 1.00000
Hg3 Hg 0.50000 0.80397 0.00000 1.00000
Hg4 Hg 0.50000 0.19603 1.00000 1.00000
Get direct link