Na3(ZnGe2)2
Alexandria ALEXAlex-ID: agm005673536 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3C4_300_spg12
Na(ZnGe)2 NaGe
2023-06-27 11:30:42.284006
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005673536).
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 agm005673536
data_agm005673536
_cell_length_a 4.22588
_cell_length_b 6.20982
_cell_length_c 9.90647
_cell_angle_alpha 59.47602
_cell_angle_beta 77.68483
_cell_angle_gamma 70.10740
_cell_volume 210.31360
_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 0.33511 0.66450 0.66528 1.00000
Na2 Na 0.00000 0.00000 0.00000 1.00000
Na3 Na 0.66489 0.33550 0.33472 1.00000
Zn1 Zn 0.39397 0.93214 0.27992 1.00000
Zn2 Zn 0.60603 0.06786 0.72008 1.00000
Ge1 Ge 0.28631 0.37332 0.05407 1.00000
Ge2 Ge 0.71369 0.62668 0.94593 1.00000
Ge3 Ge 0.05471 0.28265 0.60793 1.00000
Ge4 Ge 0.94529 0.71735 0.39207 1.00000
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