LaAgGe2
Alexandria ALEXAlex-ID: agm005693093 · Space group: Pnma (#62)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2_549_spg62
La(AgGe)2 La4Ge7 Ge
2023-07-12 04:40:05.254686
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005693093).
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 agm005693093
data_agm005693093
_cell_length_a 4.43302
_cell_length_b 11.30794
_cell_length_c 14.33535
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 718.60673
_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
La1 La 0.75000 0.46839 0.70191 1.00000
La2 La 0.25000 0.96839 0.79809 1.00000
La3 La 0.25000 0.53161 0.29809 1.00000
La4 La 0.75000 0.03161 0.20191 1.00000
La5 La 0.75000 0.24952 0.95196 1.00000
La6 La 0.25000 0.74952 0.54804 1.00000
La7 La 0.25000 0.75048 0.04804 1.00000
La8 La 0.75000 0.25048 0.45196 1.00000
Ag1 Ag 0.75000 0.54685 0.94298 1.00000
Ag2 Ag 0.25000 0.04685 0.55702 1.00000
Ag3 Ag 0.25000 0.45315 0.05702 1.00000
Ag4 Ag 0.75000 0.95315 0.44298 1.00000
Ag5 Ag 0.75000 0.32590 0.20597 1.00000
Ag6 Ag 0.25000 0.82590 0.29403 1.00000
Ag7 Ag 0.25000 0.67410 0.79403 1.00000
Ag8 Ag 0.75000 0.17410 0.70597 1.00000
Ge1 Ge 0.75000 0.97480 0.95940 1.00000
Ge2 Ge 0.25000 0.47480 0.54060 1.00000
Ge3 Ge 0.25000 0.02520 0.04060 1.00000
Ge4 Ge 0.75000 0.52520 0.45940 1.00000
Ge5 Ge 0.75000 0.77188 0.88919 1.00000
Ge6 Ge 0.25000 0.27188 0.61081 1.00000
Ge7 Ge 0.25000 0.22812 0.11081 1.00000
Ge8 Ge 0.75000 0.72812 0.38919 1.00000
Ge9 Ge 0.75000 0.75670 0.70626 1.00000
Ge10 Ge 0.25000 0.25670 0.79374 1.00000
Ge11 Ge 0.25000 0.24330 0.29374 1.00000
Ge12 Ge 0.75000 0.74330 0.20626 1.00000
Ge13 Ge 0.75000 0.95715 0.63314 1.00000
Ge14 Ge 0.25000 0.45715 0.86686 1.00000
Ge15 Ge 0.25000 0.04285 0.36686 1.00000
Ge16 Ge 0.75000 0.54285 0.13314 1.00000
