LiGe4Pd7
Alexandria ALEXAlex-ID: agm003664553 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7_87_spg12
LiGePd2 GePd GePd2
2022-04-20 10:24:42.179936
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003664553).
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 agm003664553
data_agm003664553
_cell_length_a 4.46017
_cell_length_b 7.69380
_cell_length_c 6.35337
_cell_angle_alpha 83.11826
_cell_angle_beta 69.45099
_cell_angle_gamma 73.15072
_cell_volume 195.34408
_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 0.00000 0.00000 0.00000 1.00000
Ge1 Ge 0.57393 0.21338 0.63875 1.00000
Ge2 Ge 0.42607 0.78662 0.36125 1.00000
Ge3 Ge 0.71483 0.67067 0.89966 1.00000
Ge4 Ge 0.28517 0.32933 0.10034 1.00000
Pd1 Pd 0.78550 0.87216 0.55684 1.00000
Pd2 Pd 0.21450 0.12784 0.44316 1.00000
Pd3 Pd 0.08371 0.66441 0.16817 1.00000
Pd4 Pd 0.91629 0.33559 0.83183 1.00000
Pd5 Pd 0.35372 0.58373 0.70884 1.00000
Pd6 Pd 0.50000 0.00000 0.00000 1.00000
Pd7 Pd 0.64628 0.41627 0.29116 1.00000
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