DyTm2ScSe4
Alexandria ALEXAlex-ID: agm004778221 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
ABC2D4_343_spg10
DyTmSe2 TmSe ScSe
2023-01-29 05:54:09.885466
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm004778221).
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 agm004778221
data_agm004778221
_cell_length_a 3.96250
_cell_length_b 6.93134
_cell_length_c 6.97457
_cell_angle_alpha 71.01049
_cell_angle_beta 89.99972
_cell_angle_gamma 89.99969
_cell_volume 181.13463
_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 0.50000 1.00000 1.00000
Tm1 Tm 0.00000 0.00000 1.00000 1.00000
Tm2 Tm 0.50000 0.00000 0.50000 1.00000
Sc1 Sc 0.00000 0.49999 0.50000 1.00000
Se1 Se 0.00000 0.75062 0.74325 1.00000
Se2 Se 1.00000 0.24938 0.25675 1.00000
Se3 Se 0.50000 0.74580 0.25786 1.00000
Se4 Se 0.50000 0.25420 0.74214 1.00000
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