Ac2TbY6
Alexandria ALEXAlex-ID: agm005692337 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C6_2196_spg10
TbY15 Tb2Y7 Ac
2023-07-10 15:10:19.087234
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm005692337).
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 agm005692337
data_agm005692337
_cell_length_a 3.64682
_cell_length_b 8.82823
_cell_length_c 10.15420
_cell_angle_alpha 101.60748
_cell_angle_beta 90.00648
_cell_angle_gamma 89.99305
_cell_volume 320.22828
_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
Ac1 Ac 0.50003 0.69372 0.46126 1.00000
Ac2 Ac 0.49997 0.30628 0.53874 1.00000
Tb1 Tb 0.00000 0.00000 0.00000 1.00000
Y1 Y 0.00009 0.37508 0.21594 1.00000
Y2 Y 0.00011 0.01702 0.67612 1.00000
Y3 Y 0.99991 0.62492 0.78406 1.00000
Y4 Y 0.50001 0.31788 0.90125 1.00000
Y5 Y 0.99989 0.98298 0.32388 1.00000
Y6 Y 0.49999 0.68212 0.09875 1.00000
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