LaV2F8
Alexandria ALEXAlex-ID: agm005998153 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_1485_spg12
VF2 VF3 LaF3
2023-10-17 19:39:48.602646
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005998153).
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 agm005998153
data_agm005998153
_cell_length_a 4.28390
_cell_length_b 7.61607
_cell_length_c 6.41554
_cell_angle_alpha 126.43092
_cell_angle_beta 87.51119
_cell_angle_gamma 90.01620
_cell_volume 168.16716
_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
F1 F 0.24092 0.58660 0.17303 1.00000
F2 F 0.75908 0.41340 0.82693 1.00000
F3 F 0.74513 0.86465 0.20622 1.00000
F4 F 0.27114 0.19052 0.38059 1.00000
F5 F 0.25504 0.65854 0.79412 1.00000
F6 F 0.25487 0.13536 0.79377 1.00000
F7 F 0.72886 0.80948 0.61939 1.00000
F8 F 0.74496 0.34146 0.20588 1.00000
V1 V 0.26410 0.38226 0.76451 1.00000
V2 V 0.73590 0.61774 0.23547 1.00000
La1 La 0.00000 0.00000 0.99999 1.00000
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