Y8TcAg2
Alexandria ALEXAlex-ID: agm003528040 · Space group: C2/m (#12)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C8_259_spg8
Y3Tc Y YAg
2022-03-18 14:59:02.158815
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm003528040).
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 agm003528040
data_agm003528040
_cell_length_a 5.25567
_cell_length_b 6.92653
_cell_length_c 9.09282
_cell_angle_alpha 107.45562
_cell_angle_beta 106.79817
_cell_angle_gamma 90.00000
_cell_volume 300.92895
_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
Y1 Y 0.40890 0.56895 0.81780 1.00000
Y2 Y 0.66053 0.96404 0.32106 1.00000
Y3 Y 0.80371 0.70012 0.60742 1.00000
Y4 Y 0.97262 0.20452 0.94525 1.00000
Y5 Y 0.19629 0.29988 0.39258 1.00000
Y6 Y 0.33947 0.03596 0.67894 1.00000
Y7 Y 0.59110 0.43105 0.18220 1.00000
Y8 Y 0.02738 0.79548 0.05476 1.00000
Tc1 Tc 0.50000 0.00000 0.00000 1.00000
Ag1 Ag 0.81620 0.29239 0.63239 1.00000
Ag2 Ag 0.18380 0.70761 0.36761 1.00000
Get direct link