Nb3W8
Alexandria ALEXAlex-ID: agm007808465 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B8_244_spg2
Nb2W5 NbW3
2024-05-10 04:20:06.468240
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm007808465).
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 agm007808465
data_agm007808465
_cell_length_a 5.33757
_cell_length_b 5.33757
_cell_length_c 11.59362
_cell_angle_alpha 75.73470
_cell_angle_beta 75.73470
_cell_angle_gamma 34.95267
_cell_volume 182.80422
_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
Nb1 Nb 0.00000 0.00000 0.50000 1.00000
Nb2 Nb 0.90947 0.90947 0.13698 1.00000
Nb3 Nb 0.09053 0.09053 0.86302 1.00000
W1 W 0.72964 0.72964 0.40844 1.00000
W2 W 0.27036 0.27036 0.59156 1.00000
W3 W 0.54553 0.54553 0.68150 1.00000
W4 W 0.45447 0.45447 0.31850 1.00000
W5 W 0.82019 0.82019 0.77142 1.00000
W6 W 0.17981 0.17981 0.22858 1.00000
W7 W 0.63977 0.63977 0.04619 1.00000
W8 W 0.36023 0.36023 0.95381 1.00000
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