Dy7Mn(S2O)4
Alexandria ALEXAlex-ID: agm021305793 · Space group: Pbam (#55)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB4C7D8_0_spg55
Mn2S3 Dy2S3 Dy2SO2
2024-12-23 03:54:08
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm021305793).
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 agm021305793
data_agm021305793
_cell_length_a 3.79771
_cell_length_b 13.50688
_cell_length_c 14.92438
_cell_angle_alpha 90.00000
_cell_angle_beta 90.00000
_cell_angle_gamma 90.00000
_cell_volume 765.54982
_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 0.50000 0.78477 0.88357 1.00000
Dy2 Dy 0.00000 0.99648 0.80556 1.00000
Dy3 Dy 0.50000 0.28477 0.61643 1.00000
Dy4 Dy 0.50000 0.00000 0.50000 1.00000
Dy5 Dy 0.00000 0.49648 0.69444 1.00000
Dy6 Dy 0.00000 0.21985 0.33709 1.00000
Dy7 Dy 0.00000 0.50352 0.30556 1.00000
Dy8 Dy 0.50000 0.21523 0.11643 1.00000
Dy9 Dy 0.00000 0.78015 0.66291 1.00000
Dy10 Dy 0.00000 0.00352 0.19444 1.00000
Dy11 Dy 0.50000 0.50000 0.00000 1.00000
Dy12 Dy 0.50000 0.71523 0.38357 1.00000
Dy13 Dy 0.00000 0.71985 0.16291 1.00000
Dy14 Dy 0.00000 0.28015 0.83709 1.00000
Mn1 Mn 0.50000 0.50000 0.50000 1.00000
Mn2 Mn 0.50000 0.00000 0.00000 1.00000
S1 S 0.00000 0.37664 0.46416 1.00000
S2 S 0.00000 0.12336 0.96416 1.00000
S3 S 0.50000 0.65779 0.73496 1.00000
S4 S 0.00000 0.87664 0.03584 1.00000
S5 S 0.00000 0.85760 0.47192 1.00000
S6 S 0.50000 0.15779 0.76504 1.00000
S7 S 0.50000 0.84221 0.23496 1.00000
S8 S 0.50000 0.34221 0.26504 1.00000
S9 S 0.50000 0.57063 0.16970 1.00000
S10 S 0.00000 0.35760 0.02808 1.00000
S11 S 0.50000 0.07063 0.33030 1.00000
S12 S 0.00000 0.64240 0.97192 1.00000
S13 S 0.50000 0.42937 0.83030 1.00000
S14 S 0.50000 0.92937 0.66970 1.00000
S15 S 0.00000 0.14240 0.52808 1.00000
S16 S 0.00000 0.62336 0.53584 1.00000
O1 O 0.50000 0.54570 0.37968 1.00000
O2 O 0.50000 0.45430 0.62032 1.00000
O3 O 0.00000 0.82533 0.81133 1.00000
O4 O 0.50000 0.04570 0.12032 1.00000
O5 O 0.50000 0.95430 0.87968 1.00000
O6 O 0.00000 0.17467 0.18867 1.00000
O7 O 0.00000 0.32533 0.68867 1.00000
O8 O 0.00000 0.67467 0.31133 1.00000
