HgGeSb
Alexandria ALEXAlex-ID: agm005694931 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC_10845_spg1
Hg Ge Sb
2023-06-17 13:56:59.618637
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005694931).
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 agm005694931
data_agm005694931
_cell_length_a 3.87208
_cell_length_b 8.32368
_cell_length_c 6.43675
_cell_angle_alpha 93.26574
_cell_angle_beta 95.53354
_cell_angle_gamma 61.20591
_cell_volume 180.94498
_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
Hg1 Hg 0.48201 0.81602 0.09905 1.00000
Hg2 Hg 0.92942 0.30259 0.14601 1.00000
Ge1 Ge 0.65592 0.41944 0.52021 1.00000
Ge2 Ge 0.16442 0.93632 0.72104 1.00000
Sb1 Sb 0.84262 0.70824 0.50764 1.00000
Sb2 Sb 0.36683 0.22421 0.77435 1.00000
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