Zn12Ge4Rh
Alexandria ALEXAlex-ID: agm099469745 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C12_333_spg123
Zn53Rh7 Zn Ge
2025-04-21 13:48:08
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm099469745).
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 agm099469745
data_agm099469745
_cell_length_a 3.99334
_cell_length_b 9.04518
_cell_length_c 7.88278
_cell_angle_alpha 89.53426
_cell_angle_beta 90.09669
_cell_angle_gamma 89.86759
_cell_volume 284.71912
_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
Zn1 Zn 0.50185 0.03938 0.75034 1.00000
Zn2 Zn 0.51183 0.04252 0.27703 1.00000
Zn3 Zn 0.49764 0.47706 0.74024 1.00000
Zn4 Zn 0.49925 0.46540 0.27291 1.00000
Zn5 Zn 0.49600 0.82833 0.02226 1.00000
Zn6 Zn 0.49450 0.76835 0.35043 1.00000
Zn7 Zn 0.50070 0.25215 0.98742 1.00000
Zn8 Zn 0.50535 0.26047 0.50565 1.00000
Zn9 Zn 0.99662 0.70578 0.87053 1.00000
Zn10 Zn 0.99554 0.65895 0.19347 1.00000
Zn11 Zn 0.00373 0.24286 0.71226 1.00000
Zn12 Zn 0.00712 0.24293 0.29170 1.00000
Ge1 Ge 0.00206 0.05316 0.01561 1.00000
Ge2 Ge 0.99641 0.92280 0.54712 1.00000
Ge3 Ge 0.99950 0.42934 0.99862 1.00000
Ge4 Ge 0.99570 0.59883 0.53672 1.00000
Rh1 Rh 0.49621 0.76169 0.67768 1.00000
Get direct link