TiVW14
Alexandria ALEXAlex-ID: agm005807600 · Space group: Cmmm (#65)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC14_15_spg38
TiW15 VW5 TiW8
2023-07-19 04:57:22.150536
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005807600).
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 agm005807600
data_agm005807600
_cell_length_a 5.49381
_cell_length_b 5.49381
_cell_length_c 8.97761
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 109.50042
_cell_volume 255.41882
_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
Ti1 Ti 0.62500 0.37500 0.50000 1.00000
V1 V 0.12503 0.87497 0.50000 1.00000
W1 W 0.12500 0.87500 0.00000 1.00000
W2 W 0.62500 0.37500 0.00000 1.00000
W3 W 0.12501 0.37499 0.50000 1.00000
W4 W 0.12500 0.37500 0.00000 1.00000
W5 W 0.62501 0.87499 0.50000 1.00000
W6 W 0.62500 0.87500 0.00000 1.00000
W7 W 0.37350 0.12351 0.74914 1.00000
W8 W 0.37350 0.12351 0.25086 1.00000
W9 W 0.87649 0.62650 0.74914 1.00000
W10 W 0.87649 0.62650 0.25086 1.00000
W11 W 0.37525 0.62475 0.74781 1.00000
W12 W 0.37525 0.62475 0.25219 1.00000
W13 W 0.87474 0.12526 0.74782 1.00000
W14 W 0.87474 0.12526 0.25218 1.00000
Get direct link