Li4ZrGe2
Alexandria ALEXAlex-ID: agm005485272 · Space group: R-3m (#166)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_564_spg166
Li8Ge3 Li15Ge4 Zr5Ge4
2023-03-17 23:23:54.498783
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005485272).
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 agm005485272
data_agm005485272
_cell_length_a 7.59934
_cell_length_b 7.59934
_cell_length_c 7.59934
_cell_angle_alpha 34.05071
_cell_angle_beta 34.05071
_cell_angle_gamma 34.05071
_cell_volume 122.65547
_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
Li1 Li 0.92566 0.92566 0.92566 1.00000
Li2 Li 0.74886 0.74886 0.74886 1.00000
Li3 Li 0.07434 0.07434 0.07434 1.00000
Li4 Li 0.25114 0.25114 0.25114 1.00000
Zr1 Zr 0.50000 0.50000 0.50000 1.00000
Ge1 Ge 0.62419 0.62419 0.62419 1.00000
Ge2 Ge 0.37581 0.37581 0.37581 1.00000
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