AlV6Mo5
Alexandria ALEXAlex-ID: agm006113398 · Space group: Immm (#71)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB5C6_53_spg71
V4Mo3 VMo Al2(VMo)3
2023-09-16 02:12:58.423839
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006113398).
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 agm006113398
data_agm006113398
_cell_length_a 4.32464
_cell_length_b 6.16709
_cell_length_c 7.53564
_cell_angle_alpha 114.15504
_cell_angle_beta 106.63270
_cell_angle_gamma 89.99932
_cell_volume 174.12523
_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
Mo1 Mo 0.65917 0.15935 0.31871 1.00000
Mo2 Mo 0.33098 0.33105 0.66210 1.00000
Mo3 Mo 0.00000 0.50000 0.00000 1.00000
Mo4 Mo 0.66902 0.66895 0.33790 1.00000
Mo5 Mo 0.34083 0.84065 0.68129 1.00000
Al1 Al 0.00000 0.00000 0.00000 1.00000
V1 V 0.83090 0.57654 0.66187 1.00000
V2 V 0.83088 0.08533 0.66187 1.00000
V3 V 0.50000 0.73806 0.99998 1.00000
V4 V 0.50000 0.26194 0.00002 1.00000
V5 V 0.16912 0.91467 0.33813 1.00000
V6 V 0.16910 0.42346 0.33813 1.00000
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