Nb4Mo3W4
Alexandria ALEXAlex-ID: agm005703616 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A3B4C4_25_spg71
Nb3Mo3W2 Nb2W5 NbMo
2023-06-29 21:24:50.532302
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005703616).
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 agm005703616
data_agm005703616
_cell_length_a 2.80555
_cell_length_b 4.53638
_cell_length_c 14.64252
_cell_angle_alpha 98.88519
_cell_angle_beta 93.64216
_cell_angle_gamma 90.08119
_cell_volume 183.73561
_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 0.73297 0.08969 0.17963 1.00000
Nb2 Nb 0.18087 0.27341 0.54676 1.00000
Nb3 Nb 0.81910 0.72661 0.45324 1.00000
Nb4 Nb 0.26700 0.91034 0.82037 1.00000
Mo1 Mo 0.09562 0.63489 0.27034 1.00000
Mo2 Mo 0.90435 0.36514 0.72966 1.00000
Mo3 Mo 0.99999 0.00001 0.00000 1.00000
W1 W 0.35836 0.54442 0.08912 1.00000
W2 W 0.64162 0.45561 0.91088 1.00000
W3 W 0.55237 0.82007 0.63967 1.00000
W4 W 0.44760 0.17996 0.36033 1.00000
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