Ni(GeI2)4
Alexandria ALEXAlex-ID: agm097537519 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C8_1303_spg1
GeI4 GeI2 Ni3Ge
2025-06-22 12:12:19
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm097537519).
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 agm097537519
data_agm097537519
_cell_length_a 4.36878
_cell_length_b 10.09728
_cell_length_c 13.71066
_cell_angle_alpha 67.19770
_cell_angle_beta 97.38162
_cell_angle_gamma 79.24590
_cell_volume 534.12372
_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
Ni1 Ni 0.46281 0.13328 0.97238 1.00000
Ge1 Ge 0.01026 0.06980 0.05471 1.00000
Ge2 Ge 0.12828 0.38682 0.80578 1.00000
Ge3 Ge 0.72147 0.68167 0.29640 1.00000
Ge4 Ge 0.29608 0.78776 0.55145 1.00000
I1 I 0.27487 0.32267 0.04393 1.00000
I2 I 0.13589 0.92282 0.28972 1.00000
I3 I 0.45829 0.62434 0.78448 1.00000
I4 I 0.31185 0.49027 0.29059 1.00000
I5 I 0.87387 0.56141 0.53502 1.00000
I6 I 0.70447 0.98072 0.55478 1.00000
I7 I 0.64345 0.18805 0.78669 1.00000
I8 I 0.47842 0.85038 0.03407 1.00000
Get direct link