DyS9
Alexandria ALEXAlex-ID: agm057982471 · Space group: P1 (#1)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB9_105_spg1
DyS9
2024-12-25 15:23:07
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm057982471).
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 agm057982471
data_agm057982471
_cell_length_a 4.91954
_cell_length_b 7.22633
_cell_length_c 9.51588
_cell_angle_alpha 73.82827
_cell_angle_beta 103.02255
_cell_angle_gamma 85.50440
_cell_volume 312.92798
_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 0.17790 0.03845 0.93478 1.00000
S1 S 0.28659 0.43610 0.87238 1.00000
S2 S 0.29080 0.89699 0.38778 1.00000
S3 S 0.36898 0.12136 0.66061 1.00000
S4 S 0.42823 0.45367 0.10039 1.00000
S5 S 0.09993 0.11639 0.19147 1.00000
S6 S 0.18801 0.66783 0.12966 1.00000
S7 S 0.87642 0.39206 0.83398 1.00000
S8 S 0.65560 0.91879 0.84995 1.00000
S9 S 0.11724 0.95836 0.54930 1.00000
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