Ru2W3
Alexandria ALEXAlex-ID: agm005506473 · Space group: Fdd2 (#43)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
A2B3_55_spg43
Ru3W W
2023-03-20 12:42:57.246710
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005506473).
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
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# CIF generated by HEAS from Alexandria entry agm005506473
data_agm005506473
_cell_length_a 8.16916
_cell_length_b 7.11613
_cell_length_c 5.31392
_cell_angle_alpha 80.76148
_cell_angle_beta 59.29383
_cell_angle_gamma 39.94469
_cell_volume 154.88952
_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
Ru1 Ru 0.20875 0.89402 0.35029 1.00000
Ru2 Ru 0.54694 0.35029 0.89402 1.00000
Ru3 Ru 0.35598 0.04125 0.70306 1.00000
Ru4 Ru 0.89971 0.70306 0.04125 1.00000
W1 W 0.74769 0.45892 0.36592 1.00000
W2 W 0.42747 0.36592 0.45892 1.00000
W3 W 0.79108 0.50231 0.82253 1.00000
W4 W 0.88408 0.82253 0.50231 1.00000
W5 W 0.06915 0.93085 0.93085 1.00000
W6 W 0.31915 0.18085 0.18085 1.00000
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