LaGeF7
Alexandria ALEXAlex-ID: agm024243311 · Space group: P2_1 (#4)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC7_80_spg2
LaGeF7
2024-11-24 23:06:00.797743
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm024243311).
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 agm024243311
data_agm024243311
_cell_length_a 5.64937
_cell_length_b 6.13864
_cell_length_c 8.26710
_cell_angle_alpha 78.18773
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 280.62717
_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 0.75479 0.16791 0.80692 1.00000
La2 La 0.25479 0.83209 0.19308 1.00000
Ge1 Ge 0.76793 0.30606 0.27847 1.00000
Ge2 Ge 0.26793 0.69394 0.72153 1.00000
F1 F 0.41235 0.08062 0.96980 1.00000
F2 F 0.91235 0.91938 0.03020 1.00000
F3 F 0.49319 0.47908 0.72393 1.00000
F4 F 0.99319 0.52092 0.27607 1.00000
F5 F 0.75547 0.26835 0.50254 1.00000
F6 F 0.25547 0.73165 0.49746 1.00000
F7 F 0.03784 0.47836 0.74100 1.00000
F8 F 0.53784 0.52164 0.25900 1.00000
F9 F 0.50756 0.90015 0.70132 1.00000
F10 F 0.00756 0.09985 0.29868 1.00000
F11 F 0.54762 0.08580 0.28770 1.00000
F12 F 0.04762 0.91420 0.71230 1.00000
F13 F 0.78516 0.35058 0.05350 1.00000
F14 F 0.28516 0.64942 0.94650 1.00000
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