MnZn2GeN4
Alexandria ALEXAlex-ID: agm004872014 · Space group: I-42m (#121)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_409_spg121
MnZn2N3 MnN ZnGeN2
2023-01-27 21:23:30.816822
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004872014).
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
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# CIF generated by HEAS from Alexandria entry agm004872014
data_agm004872014
_cell_length_a 4.54171
_cell_length_b 4.54171
_cell_length_c 5.54869
_cell_angle_alpha 114.15949
_cell_angle_beta 114.15949
_cell_angle_gamma 90.00074
_cell_volume 93.33257
_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
Mn1 Mn 0.00004 0.00004 0.00008 1.00000
Zn1 Zn 0.75003 0.25003 0.50007 1.00000
Zn2 Zn 0.25003 0.75003 0.50007 1.00000
Ge1 Ge 0.50004 0.50004 0.00007 1.00000
N1 N 0.63826 0.63826 0.77701 1.00000
N2 N 0.36182 0.86134 0.22315 1.00000
N3 N 0.86134 0.36182 0.22315 1.00000
N4 N 0.13874 0.13874 0.77700 1.00000
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