Na3TmF7
Alexandria ALEXAlex-ID: agm002149142 · Space group: Cm (#8)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB3C7_10_spg8
NaF3 NaTmF4 NaF
2018-06-12 15:34:11
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm002149142).
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 agm002149142
data_agm002149142
_cell_length_a 5.71553
_cell_length_b 5.71553
_cell_length_c 6.23876
_cell_angle_alpha 62.46066
_cell_angle_beta 62.46066
_cell_angle_gamma 88.16445
_cell_volume 155.89570
_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
Na1 Na 0.77203 0.21818 0.51273 1.00000
Na2 Na 0.49320 0.49320 0.07622 1.00000
Na3 Na 0.21818 0.77203 0.51273 1.00000
Tm1 Tm 0.05687 0.05687 0.95161 1.00000
F1 F 0.85913 0.85913 0.83945 1.00000
F2 F 0.84655 0.37158 0.78855 1.00000
F3 F 0.65354 0.05234 0.27045 1.00000
F4 F 0.37158 0.84655 0.78855 1.00000
F5 F 0.37989 0.37989 0.55962 1.00000
F6 F 0.05234 0.65354 0.27045 1.00000
F7 F 0.17171 0.17171 0.17962 1.00000
Get direct link