Dy(Er4Th3)2
Alexandria ALEXAlex-ID: agm006061925 · Space group: R-3 (#148)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB6C8_84_spg148
DyErTh2 DyTh4 Er2Th
2023-08-31 04:00:28.135540
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm006061925).
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 agm006061925
data_agm006061925
_cell_length_a 8.71222
_cell_length_b 8.71222
_cell_length_c 8.71222
_cell_angle_alpha 60.73248
_cell_angle_beta 60.73248
_cell_angle_gamma 60.73248
_cell_volume 475.32556
_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
Dy1 Dy 0.00000 0.00000 0.00000 1.00000
Er1 Er 0.11994 0.67534 0.80313 1.00000
Er2 Er 0.19687 0.88006 0.32466 1.00000
Er3 Er 0.32466 0.19687 0.88006 1.00000
Er4 Er 0.57948 0.57948 0.57948 1.00000
Er5 Er 0.42052 0.42052 0.42052 1.00000
Er6 Er 0.67534 0.80313 0.11994 1.00000
Er7 Er 0.80313 0.11994 0.67534 1.00000
Er8 Er 0.88006 0.32466 0.19687 1.00000
Th1 Th 0.92688 0.46509 0.73535 1.00000
Th2 Th 0.26465 0.07312 0.53491 1.00000
Th3 Th 0.53491 0.26465 0.07312 1.00000
Th4 Th 0.46509 0.73535 0.92688 1.00000
Th5 Th 0.73535 0.92688 0.46509 1.00000
Th6 Th 0.07312 0.53491 0.26465 1.00000
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