Np2ZnGe3
Alexandria ALEXAlex-ID: agm016572830 · Space group: P-1 (#2)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C3_5620_spg12
Np2Zn17 Np2ZnGe5 Np2Ge
2024-09-13 12:42:10.322082
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm016572830).
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 agm016572830
data_agm016572830
_cell_length_a 5.12274
_cell_length_b 5.99002
_cell_length_c 8.14953
_cell_angle_alpha 73.84406
_cell_angle_beta 82.10312
_cell_angle_gamma 77.98139
_cell_volume 234.08830
_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
Np1 Np 0.25444 0.09291 0.40999 1.00000
Np2 Np 0.75456 0.59361 0.91013 1.00000
Np3 Np 0.24544 0.40639 0.08987 1.00000
Np4 Np 0.74556 0.90709 0.59001 1.00000
Zn1 Zn 0.75156 0.75206 0.24931 1.00000
Zn2 Zn 0.24844 0.24794 0.75069 1.00000
Ge1 Ge 0.25037 0.74942 0.74972 1.00000
Ge2 Ge 0.74963 0.25058 0.25028 1.00000
Ge3 Ge 0.72656 0.09886 0.91204 1.00000
Ge4 Ge 0.77268 0.40270 0.58706 1.00000
Ge5 Ge 0.22732 0.59730 0.41294 1.00000
Ge6 Ge 0.27344 0.90114 0.08796 1.00000
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